SCHEMBL9289259

SCHEMBL9289259

O=C(O)c1cccc(-c2ccccc2)c1S

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HNF4A P41235 1/20 0.63
FABP3 P05413 1/20 0.53
FABP4 P15090 1/20 0.53
FABP5 Q01469 1/20 0.53
MAPT P10636 2/20 0.52
HDAC8 Q9BY41 1/20 0.52
BCAT2 O15382 1/20 0.52
ALDH1A1 P00352 4/20 0.50
ALOX15 P16050 1/20 0.50
SMN1; SMN2 Q16637 2/20 0.47
MYC P01106 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
LMNA P02545 1/20 0.47
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
HSD17B10 Q99714 1/20 0.47
FOLH1 Q04609 3/20 0.46
PTPN1 P18031 1/20 0.46
CHRNB2 P17787 1/20 0.46
CHRNB4 P30926 1/20 0.46

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
SCHEMBL1465739 0.86 MAPT (0.54) HNF4AMAPTHDAC8ALDH1A1ALOX15
SCHEMBL7079586 0.85 BCAT2 (0.69) HNF4AFABP3FABP4FABP5MAPT
SCHEMBL3069640 0.84 FOLH1 (0.50) HNF4AFABP3FABP4FABP5MAPT
SCHEMBL7407371 0.83 HNF4A (0.73) HNF4AFABP3FABP4FABP5MAPT
Methane SCHEMBL28640150 0.82 ALDH1A1 (0.53) HNF4AMAPTBCAT2ALDH1A1SMN1; SMN2
Benzene SCHEMBL28480917 0.81 HNF4A (0.69) HNF4AFABP3FABP4FABP5BCAT2
Benzene SCHEMBL1403559 0.81 HNF4A (0.69) HNF4AFABP3FABP4FABP5BCAT2
SCHEMBL133057 0.81 HNF4A (0.69) HNF4AFABP3FABP4FABP5BCAT2
SCHEMBL26624744 0.81 HNF4A (0.69) HNF4AFABP3FABP4FABP5BCAT2
SCHEMBL2162181 0.80 MAPT (0.61) HNF4AMAPTHDAC8ALDH1A1ALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107129458-B Carbazole oxime ester compound and synthesis method and application thereof 江苏和成新材料有限公司 2021-02-09 CN disclosed
CN-106278967-B Acyl oxime ester compound for UV curing material and synthetic method and application thereof 江苏和成新材料有限公司 2020-08-07 CN disclosed
US-5434264-A α,α-disubstituted aromatics and heteroaromatics as cognition enhancers THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) 1995-07-18 US disclosed
US-5300642-A α, α-disubstituted aromatics and heteroaromatics as cognition enhancers THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) 1994-04-05 US disclosed
EP-0311010-B1 Alpha,Alpha-disubstituted aromatics and heteroaromatics as cognition enhancers DU PONT MERCK PHARMA (US) 1994-02-02 EP disclosed
EP-0532054-A1 Process for preparing alpha,alpha-disubstituted aromatics and heteroaromatics as cognition enhancers THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) 1993-03-17 EP disclosed
US-5173489-A α,α-disubstituted aromatics and heteroaromatics as cognition enhancers THE DUPONT MERCK PHARMACEUTICAL CO. (US) 1992-12-22 US disclosed
EP-0311010-A2 Alpha,Alpha-disubstituted aromatics and heteroaromatics as cognition enhancers THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) 1989-04-12 EP disclosed