SCHEMBL9355260

SCHEMBL9355260

C=CCC(Cc1ccccc1)=C(CC(=O)O)C(=O)O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKR1B1 P15121 1/20 0.44
CES1 P23141 2/20 0.40
CES2 O00748 1/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
HDAC8 Q9BY41 1/20 0.40
HDAC6 Q9UBN7 1/20 0.40
CYP3A4 P08684 1/20 0.39
CYP2C9 P11712 1/20 0.39
CTBP2 P56545 1/20 0.38
EPHX2 P34913 1/20 0.38
PAM P19021 2/20 0.37
ATM Q13315 1/20 0.36
ABCC4 O15439 1/20 0.36
LMNA P02545 1/20 0.36
GAA P10253 1/20 0.36
TSHR P16473 1/20 0.36
PTGS1 P23219 1/20 0.36
HTT P42858 1/20 0.36
KDM4E B2RXH2 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
SCHEMBL9354985 0.85 AKR1B1 (0.56) AKR1B1CES1CES2MEN1KMT2A
SCHEMBL17975858 0.79 ALOX15 (0.40) ABCC4TSHRKDM4EFNTAFNTB
SCHEMBL9355509 0.79 AKR1B1 (0.48) AKR1B1CES1CES2MEN1KMT2A
SCHEMBL9709391 0.78 CES1 (0.47) AKR1B1CES1CES2MEN1KMT2A
SCHEMBL9709396 0.78 CES1 (0.47) AKR1B1CES1CES2MEN1KMT2A
SCHEMBL9860999 0.78 CES1 (0.47) AKR1B1CES1CES2MEN1KMT2A
SCHEMBL9355218 0.78 AKR1B1 (0.44) AKR1B1CES1CES2MEN1KMT2A
SCHEMBL6521011 0.78 AKR1B1 (0.47) AKR1B1CES1CES2MEN1KMT2A
SCHEMBL6518197 0.76 MEN1 (0.50) AKR1B1CES1CES2MEN1KMT2A
SCHEMBL6519461 0.75 ALDH1A1 (0.48) AKR1B1CES1CES2MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0242618-B1 Transparent optical article and process for preparing same NIPPON OILS & FATS CO LTD (JP) 1994-11-02 EP claimed