SCHEMBL30746419

SCHEMBL30746419

COc1ccc(CNc2nccc(Cc3cncc(Nc4ccc(Cl)cc4F)c3F)c2F)c(OC)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP1A2 P05177 13/20 0.43
▸ CYP3A4 P08684 13/20 0.43
▸ CYP2D6 P10635 13/20 0.43
▸ CYP2C19 P33261 13/20 0.43
▸ TSHR P16473 11/20 0.43
▸ ALDH1A1 P00352 6/20 0.43
▸ HSD17B10 Q99714 6/20 0.43
▸ CYP2C9 P11712 5/20 0.43
▸ HIF1A Q16665 2/20 0.43
▸ TDP1 Q9NUW8 1/20 0.43
▸ KDM4E B2RXH2 1/20 0.41
▸ KDR P35968 3/20 0.41
▸ KDM4C Q9H3R0 2/20 0.41
▸ CLK4 Q9HAZ1 7/20 0.40
▸ MAPK1 P28482 2/20 0.40
▸ LMNA P02545 6/20 0.40
▸ USP2 O75604 6/20 0.40
▸ ALOX15 P16050 4/20 0.40
▸ FGFR1 P11362 2/20 0.40
▸ FLT1 P17948 2/20 0.40

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
SCHEMBL26985343 1.00 CYP1A2 (0.43) CYP1A2CYP3A4CYP2D6CYP2C19TSHR
SCHEMBL26985477 0.94 CYP1A2 (0.42) CYP1A2CYP3A4CYP2D6CYP2C19TSHR
SCHEMBL26985134 0.94 CYP1A2 (0.42) CYP1A2CYP3A4CYP2D6CYP2C19TSHR
SCHEMBL30746372 0.94 CYP1A2 (0.42) CYP1A2CYP3A4CYP2D6CYP2C19TSHR
SCHEMBL30746673 0.91 CYP1A2 (0.41) CYP1A2CYP3A4CYP2D6CYP2C19TSHR
SCHEMBL26984891 0.91 CYP1A2 (0.41) CYP1A2CYP3A4CYP2D6CYP2C19TSHR
SCHEMBL31401688 0.84 CYP1A2 (0.44) CYP1A2CYP3A4CYP2D6CYP2C19TSHR
SCHEMBL30746539 0.84 CYP1A2 (0.42) CYP1A2CYP3A4CYP2D6CYP2C19TSHR
SCHEMBL26984969 0.84 CYP1A2 (0.42) CYP1A2CYP3A4CYP2D6CYP2C19TSHR
SCHEMBL30746514 0.84 CYP1A2 (0.40) CYP1A2CYP3A4CYP2D6CYP2C19TSHR

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-120129678-A Mitogen-activated protein kinase (MEK) inhibitors 耐斯泰德医疗公司 2025-06-10 — — CN disclosed
EP-4551558-A2 MITOGEN-ACTIVATED PROTEIN KINASE (MEK) INHIBITORS Nested Therapeutics, Inc. (US) 2025-05-14 — — EP disclosed
WO-2024010925-A2 MITOGEN-ACTIVATED PROTEIN KINASE (MEK) INHIBITORS NESTED THERAPEUTICS, INC. (US) 2024-01-11 — — WO disclosed
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