SCHEMBL1805930

SCHEMBL1805930

Cc1c(C(N)=O)cccc1[N+](=O)[O-]

nearest known ligand 0.72

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.72
TDP1 Q9NUW8 3/20 0.62
GLA P06280 1/20 0.57
SMN1; SMN2 Q16637 2/20 0.56
L3MBTL1 Q9Y468 2/20 0.54
KMT2A Q03164 4/20 0.54
MEN1 O00255 3/20 0.54
CYP2C9 P11712 1/20 0.54
DHODH Q02127 1/20 0.54
ALDH1A1 P00352 2/20 0.53
LMNA P02545 2/20 0.52
GAA P10253 1/20 0.52
MAPT P10636 1/20 0.52
NPC1 O15118 1/20 0.52
MAPK1 P28482 1/20 0.52
RAB9A P51151 1/20 0.52
HPGD P15428 2/20 0.50
POLB P06746 1/20 0.49
ATM Q13315 1/20 0.49

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
SCHEMBL1784383 0.84 TSHR (0.65) TSHRTDP1GLASMN1; SMN2L3MBTL1
SCHEMBL2932050 0.84 TSHR (0.74) TSHRTDP1GLASMN1; SMN2L3MBTL1
SCHEMBL30041946 0.84 TSHR (0.74) TSHRTDP1GLASMN1; SMN2L3MBTL1
SCHEMBL1117860 0.84 TSHR (0.50) TSHRTDP1GLASMN1; SMN2L3MBTL1
SCHEMBL33663 0.84 TSHR (1.00) TSHRTDP1GLASMN1; SMN2L3MBTL1
Hydrochloric Acid SCHEMBL6407719 0.82 TSHR (0.96) TSHRTDP1GLASMN1; SMN2L3MBTL1
SCHEMBL1805928 0.82 TSHR (0.72) TSHRTDP1GLASMN1; SMN2L3MBTL1
Ammonia Solution, Strong SCHEMBL8032064 0.82 TSHR (0.96) TSHRTDP1GLASMN1; SMN2L3MBTL1
SCHEMBL5727143 0.82 TSHR (0.72) TSHRTDP1GLASMN1; SMN2L3MBTL1
Hydrochloric Acid SCHEMBL5787034 0.82 TSHR (0.96) TSHRTDP1GLASMN1; SMN2L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1126833-A4 OXADIAZOLE, THIADIAZOLE AND TRIAZOLE DERIVATIVES AND COMBINATORIAL LIBRARIES THEREOF TREGA BIOSCIENCES INC (US) 2004-09-08 EP claimed
EP-1150565-A1 THIAZOLE DERIVATIVES AND COMBINATORIAL LIBRARIES THEREOF LION bioscience AG (DE) 2001-11-07 EP claimed
EP-1126833-A2 OXADIAZOLE, THIADIAZOLE AND TRIAZOLE DERIVATIVES AND COMBINATORIAL LIBRARIES THEREOF TREGA BIOSCIENCES, INC. (US) 2001-08-29 EP claimed
WO-2000045635-A1 THIAZOLE DERIVATIVES AND COMBINATORIAL LIBRARIES THEREOF LION BIOSCIENCE AG (DE) 2000-08-10 WO claimed
WO-2000025768-A1 OXADIAZOLE, THIADIAZOLE AND TRIAZOLE DERIVATIVES AND COMBINATORIAL LIBRARIES THEREOF TREGA BIOSCIENCES, INC. (US) 2000-05-11 WO claimed
US-12528797-B2 Heterocyclic compounds for medical treatment C4 THERAPEUTICS, INC. 2026-01-20 US disclosed
WO-2024130095-A9 COMPOUNDS AND COMPOSITIONS AS CBP/P300 DEGRADERS AND USES THEREOF REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2024-08-02 WO disclosed
US-20230019060-A1 HETEROCYCLIC COMPOUNDS FOR MEDICAL TREATMENT C4 THERAPEUTICS, INC. (US) 2023-01-19 US disclosed
CN-103333132-A N-(4-tertbutyl-5-benzyl thiazole-2-yl)amide and preparation method and application thereof UNIV HUNAN 2013-10-02 CN disclosed
US-8404036-B2 Water-soluble near-infrared absorbing coloring matters and aqueous inks containing same NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2013-03-26 US disclosed
US-8242275-B2 Bicyclic pyrazole compounds as antibacterial agents JANSSEN PHARMACEUTICA NV (BE) 2012-08-14 US disclosed
US-8232391-B2 Bicyclic pyrazole compounds as antibacterial agents JANSSEN PHARMACEUTICA NV (BE) 2012-07-31 US disclosed
WO-2005000794-A1 PROPIONAMIDE DERIVATIVES USEFUL AS ANDROGEN RECEPTOR MODULATORS ORION CORPORATION (FI) 2005-01-06 WO disclosed
US-20040214818-A1 Triazole derivative YAMANOUCHI PHARMACEUTICAL CO., LTD., MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG 2004-10-28 US disclosed
EP-1126833-A4 OXADIAZOLE, THIADIAZOLE AND TRIAZOLE DERIVATIVES AND COMBINATORIAL LIBRARIES THEREOF TREGA BIOSCIENCES INC (US) 2004-09-08 EP disclosed
US-20030216385-A1 Triazole derivatives YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) 2003-11-20 US disclosed
CN-1429215-A Triazole derivatives YAMANOUCHI PHARMA CO LTD (JP) 2003-07-09 CN disclosed
EP-1293503-A1 TRIAZOLE DERIVATIVES YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) 2003-03-19 EP disclosed
EP-1126833-A2 OXADIAZOLE, THIADIAZOLE AND TRIAZOLE DERIVATIVES AND COMBINATORIAL LIBRARIES THEREOF TREGA BIOSCIENCES, INC. (US) 2001-08-29 EP disclosed
WO-2000025768-A1 OXADIAZOLE, THIADIAZOLE AND TRIAZOLE DERIVATIVES AND COMBINATORIAL LIBRARIES THEREOF TREGA BIOSCIENCES, INC. (US) 2000-05-11 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 (4 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-20230019060-A1 HETEROCYCLIC COMPOUNDS FOR MEDICAL TREATMENT CRBN, MDM2, RBX1 TSHR 3515/4885TDP1 3277/4885GLA 3764/4885
US-20040214818-A1 Triazole derivative SLC18A3, SLC6A3, SLC18A2 TSHR 1598/4885TDP1 420/4885GLA 842/4885
US-12528797-B2 Heterocyclic compounds for medical treatment CRBN, CUL2, ADRM1 TSHR 1209/4885TDP1 3270/4885GLA 4292/4885
US-20030216385-A1 Triazole derivatives SLC18A3, SLC18A2, SLC6A3 TSHR 1550/4885TDP1 413/4885GLA 765/4885

“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.