SCHEMBL11066809

SCHEMBL11066809

Cc1ccc(C(=O)c2ccc(C)cc2)cc1.O=Cc1ccc(Cl)cc1

nearest known ligand 0.58

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAOA P21397 1/20 0.58
MAOB P27338 1/20 0.58
CES2 O00748 1/20 0.58
CES1 P23141 1/20 0.58
ALDH1A1 P00352 3/20 0.57
LMNA P02545 1/20 0.57
CYP2A6 P11509 1/20 0.57
HSD17B10 Q99714 1/20 0.57
SRD5A2 P31213 3/20 0.50
MAPK1 P28482 1/20 0.50
PTGS2 P35354 1/20 0.50
MAPT P10636 2/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
CNR1 P21554 1/20 0.49
CNR2 P34972 1/20 0.49
NPC1 O15118 1/20 0.49
RAB9A P51151 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
HPGD P15428 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
SCHEMBL13969654 0.91 ALDH1A1 (0.70) MAOAMAOBCES2CES1ALDH1A1
SCHEMBL3565290 0.91 HSD17B10 (0.70) MAOAMAOBCES2CES1ALDH1A1
SCHEMBL8070590 0.87 CYP2A6 (0.76) MAOAMAOBCES2CES1ALDH1A1
SCHEMBL195263 0.87 ALDH1A1 (0.76) MAOAMAOBCES2CES1ALDH1A1
SCHEMBL28153636 0.87 CYP2A6 (0.76) MAOAMAOBCES2CES1ALDH1A1
SCHEMBL14135917 0.87 ALDH1A1 (0.76) MAOAMAOBCES2CES1ALDH1A1
SCHEMBL16433596 0.81 PARP10 (0.62) MAOAMAOBALDH1A1LMNACYP2A6
SCHEMBL11974583 0.81 PARP10 (0.62) MAOAMAOBALDH1A1LMNACYP2A6
SCHEMBL16622242 0.81 PARP10 (0.62) MAOAMAOBALDH1A1LMNACYP2A6
SCHEMBL6852409 0.80 ALDH1A1 (0.68) ALDH1A1LMNACYP2A6HSD17B10SRD5A2

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-4477553-A AN O QUINONEDIAZIDE AND A DIHYDROXYBENZENE-BASED PHENOLIC OR POLYPHENYL RESIN BINDER; LITHOGRAPHIC PRINTING PLATES KONISHIROKU PHOTO INDUSTRY CO., LTD. (JP) 1984-10-16 US disclosed
EP-0054258-A2 Photosensitive compositions KONICA CORPORATION (JP) 1982-06-23 EP disclosed