SCHEMBL10246772

SCHEMBL10246772

C=Cc1ccc(C=O)cc1C

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 11/20 0.44
ALDH1A3 P47895 3/20 0.44
CYP2A6 P11509 4/20 0.43
TSHR P16473 2/20 0.39
KDM4E B2RXH2 2/20 0.39
RAB9A P51151 2/20 0.39
PTGS2 P35354 1/20 0.39
TDP1 Q9NUW8 2/20 0.38
HSD17B10 Q99714 1/20 0.38
HPGD P15428 2/20 0.38
MEN1 O00255 1/20 0.38
NPC1 O15118 1/20 0.38
POLB P06746 1/20 0.38
MAPT P10636 1/20 0.38
KMT2A Q03164 1/20 0.38
PTK2B Q14289 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
AOX1 Q06278 1/20 0.36
TRIM24 O15164 1/20 0.36
ALDH5A1 P51649 1/20 0.36

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
SCHEMBL823127 0.85 ALDH1A1 (0.50) ALDH1A1ALDH1A3CYP2A6TSHRKDM4E
SCHEMBL29908313 0.85 TDP1 (0.46) ALDH1A1TSHRKDM4ERAB9APTGS2
SCHEMBL7086584 0.85 TDP1 (0.46) ALDH1A1TSHRKDM4ERAB9APTGS2
SCHEMBL5126473 0.83 ALDH1A1 (0.45) ALDH1A1ALDH1A3CYP2A6TSHRRAB9A
SCHEMBL24476022 0.83 CYP2A6 (0.43) ALDH1A1ALDH1A3CYP2A6TSHRKDM4E
Water SCHEMBL20239044 0.83 TDP1 (0.45) ALDH1A1TSHRKDM4ERAB9APTGS2
SCHEMBL9798193 0.80 ALDH1A1 (0.43) ALDH1A1CYP2A6TSHRKDM4ERAB9A
SCHEMBL21317873 0.79 ALDH1A1 (0.35) ALDH1A1PTGS2TDP1
SCHEMBL28331091 0.78 ALDH1A1 (0.41) ALDH1A1CYP2A6TSHRKDM4ERAB9A
SCHEMBL13894221 0.78 ALDH1A1 (0.43) ALDH1A1ALDH1A3CYP2A6TSHRKDM4E

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-116410546-B Polypropylene resin and preparation method thereof 中国石油天然气股份有限公司 2025-02-11 CN disclosed
CN-116410546-A Polypropylene resin and preparation method thereof 中国石油天然气股份有限公司 2023-07-11 CN disclosed
EP-2413191-A1 Actinic-ray- or radiation-sensitive resin composition, resist film therefrom and method of forming pattern therewith Fujifilm Corporation (JP) 2012-02-01 EP disclosed