SCHEMBL58186

SCHEMBL58186

Cc1cc(N)ccc1B1OC(C)(C)C(C)(C)O1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.43
PDE10A Q9Y233 1/20 0.39
CASP1 P29466 4/20 0.38
CYP3A4 P08684 2/20 0.35
TSHR P16473 2/20 0.35
MAPT P10636 3/20 0.35
KDM4E B2RXH2 3/20 0.35
MEN1 O00255 2/20 0.35
THRB P10828 2/20 0.35
KMT2A Q03164 2/20 0.35
LMNA P02545 2/20 0.35
ALOX15 P16050 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
LPL P06858 5/20 0.34
LIPG Q9Y5X9 5/20 0.34
CA1 P00915 3/20 0.33
CA9 Q16790 3/20 0.33
CA2 P00918 2/20 0.33
CA12 O43570 2/20 0.33
CA3 P07451 1/20 0.33

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL29407647 1.00 ALDH1A1 (0.43) ALDH1A1PDE10ACASP1CYP3A4TSHR
SCHEMBL393594 0.85 ALDH1A1 (0.43) ALDH1A1PDE10ACASP1CYP3A4TSHR
SCHEMBL29427266 0.85 ALDH1A1 (0.43) ALDH1A1PDE10ACASP1CYP3A4TSHR
SCHEMBL28919694 0.83 CASP1 (0.39) ALDH1A1CASP1LPLLIPGCA1
SCHEMBL7162437 0.81 LPL (0.38) ALDH1A1CYP3A4MAPTKDM4ETHRB
SCHEMBL14696435 0.81 LIPG (0.45) ALDH1A1CYP3A4TSHRLPLLIPG
SCHEMBL29424563 0.81 LPL (0.38) ALDH1A1CYP3A4MAPTKDM4ETHRB
SCHEMBL28601719 0.81 LPL (0.36) ALDH1A1CASP1LPLLIPGCA1
SCHEMBL29484515 0.80 LPL (0.40) LPLLIPGCA1CA9CA2
SCHEMBL29498572 0.80 CYP3A4 (0.42) ALDH1A1CASP1CYP3A4TSHRMAPT

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 190 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12590064-B2 Substituted benzamides for inhibiting perk activity ELI LILLY AND COMPANY (US) 2026-03-31 US disclosed
US-20260042765-A1 PYRROLOTRIAZINE COMPOUNDS AS TAM INHIBITORS INCYTE CORP (US) 2026-02-12 US disclosed
EP-4306529-B1 FGFR INHIBITORS AND METHODS OF USE THEREOF RELAY THERAPEUTICS INC (US) 2026-01-21 EP disclosed
US-12522605-B2 FGFR inhibitors and methods of use thereof RELAY THERAPEUTICS, INC. (US) 2026-01-13 US disclosed
US-12473296-B2 Perk inhibiting compounds HIBERCELL, INC. (US) 2025-11-18 US disclosed
US-12415809-B2 Pyrrolotriazine compounds as tam inhibitors INCYTE CORPORATION (US) 2025-09-16 US disclosed
EP-4598523-A1 PERK INHIBITOR HC-5404 IN COMBINATION WITH ANTI-PD-1 ANTIBODY AND/OR AN ANTIANGIOGENETIC AGENT FOR USE IN THE TREATMENT OF CANCER Hibercell, Inc. (US) 2025-08-13 EP disclosed
US-20250243204-A1 FGFR INHIBITORS AND METHODS OF MAKING AND USING THE SAME RELAY THERAPEUTICS, INC. 2025-07-31 US disclosed
US-12331054-B2 Perk inhibiting imidazolopyrazine compounds HIBERCELL, INC. (US) 2025-06-17 US disclosed
WO-2024245193-A1 HETEROAROMATIC RING COMPOUND, PHARMACEUTICAL COMPOSITION THEREOF AND USE THEREOF 上海艾力斯医药科技股份有限公司 2024-12-05 WO disclosed
EP-1836174-A2 ARYL NITROGEN-CONTAINING BICYCLIC COMPOUNDS AND THEIR USE AS KINASE INHIBITORS AMGEN INC. (US) 2007-09-26 EP disclosed
US-20070054916-A1 Aryl nitrogen-containing bicyclic compounds and methods of use AMGEN INC. 2007-03-08 US disclosed
US-7138530-B2 Thiophene amidines, compositions thereof, and methods of treating complement-mediated diseases and conditions 3-DIMENSIONAL PHARMACEUTICALS, INC. (US) 2006-11-21 US disclosed
US-7109354-B2 Thiophene amidines, compositions thereof, and methods of treating complement-mediated diseases and conditions 3-DIMENSIONAL PHARMACEUTICALS, INC. (US) 2006-09-19 US disclosed
WO-2006039718-A2 ARYL NITROGEN-CONTAINING BICYCLIC COMPOUNDS AND THEIR USE AS KINASE INHIBITORS AMGEN INC (US) 2006-04-13 WO disclosed
EP-1549632-A4 NOVEL THIOPHENE AMIDINES, COMPOSITIONS THEREOF, AND METHODS OF TREATING COMPLEMENT-MEDIATED DISEASES AND CONDITIONS DIMENSIONAL PHARM INC (US) 2005-11-09 EP disclosed
US-20050234081-A1 Novel thiophene amidines, compositions thereof, and methods of treating complement-mediated diseases and conditions SUBASINGHE NALIN 2005-10-20 US disclosed
EP-1549632-A1 NOVEL THIOPHENE AMIDINES, COMPOSITIONS THEREOF, AND METHODS OF TREATING COMPLEMENT-MEDIATED DISEASES AND CONDITIONS 3-DIMENSIONAL PHARMACEUTICALS, INC. (US) 2005-07-06 EP disclosed
US-20040009995-A1 Novel thiophene amidines, compositions thereof, and methods of treating complement-mediated diseases and conditions 3-DIMENSIONAL PHARMACEUTICALS, INC. 2004-01-15 US disclosed
WO-2003099805-A1 NOVEL THIOPHENE AMIDINES, COMPOSITIONS THEREOF, AND METHODS OF TREATING COMPLEMENT-MEDIATED DISEASES AND CONDITIONS 3-DIMENSIONAL PHARMACEUTICALS, INC. (US) 2003-12-04 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (9 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20050234081-A1 Novel thiophene amidines, compositions thereof, and methods of treating complement-mediated diseases and conditions C5, C9, C1R ALDH1A1 3674/4885PDE10A 2736/4885CASP1 803/4885
US-20040009995-A1 Novel thiophene amidines, compositions thereof, and methods of treating complement-mediated diseases and conditions C5, C9, C1R ALDH1A1 2779/4885PDE10A 3188/4885CASP1 394/4885
US-20260042765-A1 PYRROLOTRIAZINE COMPOUNDS AS TAM INHIBITORS MAP2K2, TTK, MAP2K5 ALDH1A1 2069/4885PDE10A 1511/4885CASP1 2152/4885
US-12331054-B2 Perk inhibiting imidazolopyrazine compounds MAPKAPK2, MAPK4, MAP3K5 ALDH1A1 2619/4885PDE10A 2669/4885CASP1 1539/4885
US-12473296-B2 Perk inhibiting compounds MAPK1, ERN1, MAP3K20 ALDH1A1 1102/4885PDE10A 2091/4885CASP1 1971/4885
US-12415809-B2 Pyrrolotriazine compounds as tam inhibitors MERTK, MAP3K15, MAP3K5 ALDH1A1 2279/4885PDE10A 2026/4885CASP1 2411/4885
US-20070054916-A1 Aryl nitrogen-containing bicyclic compounds and methods of use MAP3K1, MAP3K5, MAP3K2 ALDH1A1 1563/4885PDE10A 2499/4885CASP1 680/4885
US-12590064-B2 Substituted benzamides for inhibiting perk activity EIF2AK3, EIF2AK1, EIF2AK4 ALDH1A1 2640/4885PDE10A 2295/4885CASP1 1897/4885
US-20250243204-A1 FGFR INHIBITORS AND METHODS OF MAKING AND USING THE SAME FGFR3, FGFR2, FGFR1 ALDH1A1 2692/4885PDE10A 3021/4885CASP1 4134/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.