SCHEMBL4640609

SCHEMBL4640609

CC(O)Sc1ccc2ccccc2c1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 1/20 0.61
UGT2B7 P16662 1/20 0.53
CYP1A2 P05177 3/20 0.46
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
CYP2D6 P10635 1/20 0.46
TSHR P16473 1/20 0.46
HIF1A Q16665 1/20 0.46
AOC3 Q16853 1/20 0.42
ATM Q13315 1/20 0.42
CYP2A6 P11509 2/20 0.41
TDP1 Q9NUW8 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
HTR2A P28223 1/20 0.40
HTR2C P28335 1/20 0.40
HTR2B P41595 1/20 0.40
BACE1 P56817 3/20 0.40
ANPEP P15144 1/20 0.40

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
SCHEMBL32662877 1.00 EPHX1 (0.61) EPHX1UGT2B7CYP1A2MEN1KMT2A
SCHEMBL5272958 0.83 EPHX1 (0.59) EPHX1UGT2B7CYP1A2CYP2A6TDP1
SCHEMBL22446622 0.79 EPHX1 (0.56) EPHX1UGT2B7CYP1A2CYP2A6TDP1
SCHEMBL7243544 0.76 EPHX1 (0.57) EPHX1UGT2B7CYP1A2AOC3CYP2A6
SCHEMBL27133621 0.76 EPHX1 (0.38) EPHX1UGT2B7CYP1A2
SCHEMBL95522 0.75 LMNA (0.42) HIF1A
SCHEMBL21751241 0.75 BCL2 (0.56) CYP1A2MEN1KMT2ACYP2D6TSHR
SCHEMBL11024562 0.75 EPHX1 (0.56) EPHX1UGT2B7MEN1KMT2ATDP1
SCHEMBL4753499 0.74 EPHX1 (0.64) EPHX1UGT2B7ANPEP
SCHEMBL8779782 0.74 EPHX1 (0.50) EPHX1UGT2B7CYP1A2CYP2A6TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108473484-B Compounds useful as TRPM8 modulators 弗门尼舍公司 2021-06-29 CN disclosed
EP-1954732-A1 COMPOSITIONS FOR BRIGHTNESS ENHANCING FILMS General Electric Company (US) 2008-08-13 EP disclosed
WO-2007001811-A1 COMPOSITIONS FOR BRIGHTNESS ENHANCING FILMS GENERAL ELECTRIC COMPANY (US) 2007-01-04 WO disclosed
US-20060293463-A1 Compositions for brightness enhancing films GENERAL ELECTRIC COMPANY 2006-12-28 US disclosed