SCHEMBL13580390

SCHEMBL13580390

Cc1cc(-c2ccc(/N=N/C=C3C=C(C(C)(C)C)C(=O)C(C(C)(C)C)=C3)c(Cl)c2)ccc1/N=N/C=C1C=C(C(C)(C)C)C(=O)C(C(C)(C)C)=C1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 3/20 0.35
▸ ALDH1A1 P00352 2/20 0.35
▸ CYP3A4 P08684 2/20 0.35
▸ THRB P10828 2/20 0.35
▸ HPGD P15428 2/20 0.35
▸ ALOX15 P16050 2/20 0.35
▸ TSHR P16473 2/20 0.35
▸ MAPK1 P28482 2/20 0.35
▸ RECQL P46063 2/20 0.35
▸ HSD17B10 Q99714 2/20 0.35
▸ MEN1 O00255 2/20 0.35
▸ KDM4E B2RXH2 1/20 0.35
▸ TP53 P04637 1/20 0.35
▸ APP P05067 1/20 0.35
▸ CYP2D6 P10635 1/20 0.35
▸ MAPT P10636 1/20 0.35
▸ CYP2C9 P11712 1/20 0.35
▸ CYP2C19 P33261 1/20 0.35
▸ SNCA P37840 1/20 0.35
▸ BRCA1 P38398 1/20 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
SCHEMBL13580321 0.94 NPC1 (0.36) KMT2ANPC1ATMGPR35
SCHEMBL13580329 0.93 KMT2A (0.39) KMT2AALDH1A1CYP3A4THRBHPGD
SCHEMBL13580735 0.89 NPC1 (0.31) KMT2ANPC1ATMGPR35
SCHEMBL13580377 0.88 NPC1 (0.33) KMT2ANPC1ATMGPR35
SCHEMBL13580387 0.87 NPC1 (0.32) KMT2ANPC1ATMGPR35
SCHEMBL13580393 0.87 KMT2A (0.38) KMT2AALDH1A1CYP3A4THRBHPGD
SCHEMBL13580380 0.85 NPC1 (0.32) KMT2ANPC1ATMGPR35
SCHEMBL13580405 0.84 SMN1; SMN2 (0.32) KMT2ANPC1ATMGPR35
SCHEMBL13580386 0.84 NPC1 (0.32) KMT2ANPC1ATMGPR35
SCHEMBL18877730 0.84 KMT2A (0.36) KMT2AALDH1A1TSHRMAPK1RECQL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090317733-A1 Quinone Compound, Electrophotographic Photoconductor and Electrophotographic Apparatus FUJI ELECTRIC DEVICE TECHNOLOGY CO., LTD. (JP) 2009-12-24 — — US disclosed
US-20090317733-A1 Quinone Compound, Electrophotographic Photoconductor and Electrophotographic Apparatus FUJI ELECTRIC DEVICE TECHNOLOGY CO., LTD. (JP) 2009-12-24 — — US disclosed
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