SCHEMBL107887

SCHEMBL107887

Fc1ccc2c[nH]cc2c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP1A2 P05177 1/20 0.50
▸ CYP2A6 P11509 1/20 0.50
▸ AHR P35869 2/20 0.43
▸ BACE1 P56817 1/20 0.40
▸ ALDH1A1 P00352 3/20 0.39
▸ KDM4E B2RXH2 2/20 0.39
▸ HPGD P15428 2/20 0.39
▸ HSD17B10 Q99714 2/20 0.39
▸ PDPK1 O15530 1/20 0.39
▸ LMNA P02545 1/20 0.39
▸ TSHR P16473 1/20 0.39
▸ NFKB1 P19838 1/20 0.39
▸ APEX1 P27695 1/20 0.39
▸ CYP2C19 P33261 1/20 0.39
▸ TDP1 Q9NUW8 1/20 0.39
▸ SLC6A2 P23975 2/20 0.37
▸ SLC6A4 P31645 2/20 0.37
▸ SLC6A3 Q01959 2/20 0.37
▸ KCNH2 Q12809 2/20 0.37
▸ DAO P14920 2/20 0.35

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
SCHEMBL30366405 0.76 CYP1A2 (0.77) CYP1A2CYP2A6AHRBACE1ALDH1A1
SCHEMBL6562601 0.76 CYP1A2 (0.77) CYP1A2CYP2A6AHRBACE1ALDH1A1
SCHEMBL29936739 0.74 CYP1A2 (0.72) CYP1A2CYP2A6AHRBACE1ALDH1A1
SCHEMBL6564751 0.74 CYP1A2 (0.72) CYP1A2CYP2A6AHRBACE1ALDH1A1
SCHEMBL11303205 0.71 CYP1A2 (0.68) CYP1A2CYP2A6AHRBACE1ALDH1A1
SCHEMBL3828830 0.71 CYP1A2 (0.68) CYP1A2CYP2A6AHRBACE1ALDH1A1
SCHEMBL18770006 0.70 CYP1A2 (0.41) CYP1A2CYP2A6AHRBACE1ALDH1A1
SCHEMBL30393840 0.69 BACE1 (0.46) CYP1A2BACE1ALDH1A1KDM4EHPGD
SCHEMBL19554284 0.68 CYP2A6 (0.56) CYP1A2CYP2A6AHRBACE1SLC6A4
SCHEMBL1413683 0.68 — —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024051766-A1 MOLECULAR GLUE COMPOUND BASED ON CEREBLON PROTEIN DESIGN AND USE THEREOF 标新生物医药科技(上海)有限公司 2024-03-14 — — WO claimed
US-20260034127-A1 TREATMENT OF GVHD KADMON CORP LLC (FR) 2026-02-05 — — US disclosed
WO-2023233024-A1 DPP9 BINDING COMPOUNDS UNIVERSITEIT ANTWERPEN (BE) 2023-12-07 — — WO disclosed
CN-116829558-A Compounds of formula (I) 艾斯法姆生物技术股份有限公司 2023-09-29 — — CN disclosed
CN-110121499-B (aza) indole-, benzothiophene-and benzofuran-3-sulfonamides 优时比制药有限公司 2022-12-20 — — CN disclosed
US-20220395501-A1 TREATMENT OF GVHD KADMON CORP LLC (US) 2022-12-15 — — US disclosed
CN-114920911-A Method for producing polyisothianaphthene-based conductive polymer 昭和电工株式会社 2022-08-19 — — CN disclosed
CN-110121516-B Method for producing polyisothianaphthene-based conductive polymer 昭和电工株式会社 2022-07-01 — — CN disclosed
US-11311541-B2 Treatment of GVHD KADMON CORPORATION, LLC (US) 2022-04-26 — — US disclosed
US-11183340-B2 Method for manufacturing solid electrolytic capacitor SHOWA DENKO K.K. (JP) 2021-11-23 — — US disclosed
WO-2015157556-A1 TREATMENT OF GVHD KADMON CORPORATION, LLC (US) 2015-10-15 — — WO disclosed
WO-2015054317-A1 RHO KINASE INHIBITORS KADMON CORPORATION, LLC (US) 2015-04-16 — — WO disclosed
EP-2205564-B1 NOVEL KINASE INHIBITORS HOFFMANN LA ROCHE (CH) 2014-07-30 — — EP disclosed
EP-2426109-B1 NOVEL KINASE INHIBITORS HOFFMANN LA ROCHE (CH) 2013-12-18 — — EP disclosed
EP-2426109-A1 NOVEL KINASE INHIBITORS F. Hoffmann-La Roche AG (CH) 2012-03-07 — — EP disclosed
US-7943618-B2 Btk protein kinase inhibitors ROCHE PALO ALTO LLC (US) 2011-05-17 — — US disclosed
CN-101835755-A Novel kinase inhibitors HOFFMANN LA ROCHE 2010-09-15 — — CN disclosed
EP-2205564-A1 NOVEL KINASE INHIBITORS F. Hoffmann-Roche AG (CH) 2010-07-14 — — EP disclosed
WO-2009053269-A1 NOVEL KINASE INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2009-04-30 — — WO disclosed
US-20090105209-A1 BTK protein kinase inhibitors ROCHE PALO ALTO LLC 2009-04-23 — — US 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-20260034127-A1 TREATMENT OF GVHD ROCK2, RHOA, MYH2 CYP1A2 1445/4885CYP2A6 3709/4885AHR 4084/4885
US-20090105209-A1 BTK protein kinase inhibitors BTK, SYK, LYN CYP1A2 3859/4885CYP2A6 4177/4885AHR 3882/4885
US-20220395501-A1 TREATMENT OF GVHD ROCK2, ROCK1, RHOXF2 CYP1A2 119/4885CYP2A6 1369/4885AHR 1195/4885
US-11311541-B2 Treatment of GVHD ROCK2, ROCK1, RHOA CYP1A2 127/4885CYP2A6 1276/4885AHR 1140/4885

“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.

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