SCHEMBL29638857

SCHEMBL29638857

Cc1c[nH]c2cc(O)c(O)cc12

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SRC P12931 3/20 0.48
PRKACA P17612 2/20 0.48
PRKACG P22612 2/20 0.48
PRKACB P22694 2/20 0.48
ATM Q13315 1/20 0.46
DAO P14920 2/20 0.40
DDO Q99489 1/20 0.40
PIM1 P11309 1/20 0.37
PIM3 Q86V86 1/20 0.37
PIM2 Q9P1W9 1/20 0.37
HTR2A P28223 2/20 0.36
HTR2C P28335 2/20 0.36
HTR2B P41595 1/20 0.36
KDM4E B2RXH2 2/20 0.35
CYP3A4 P08684 2/20 0.35
HPGD P15428 2/20 0.35
HSD17B10 Q99714 2/20 0.35
ALDH1A1 P00352 1/20 0.35
THRB P10828 1/20 0.35
AKR1B1 P15121 1/20 0.35

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
SCHEMBL435044 1.00 SRC (0.48) SRCPRKACAPRKACGPRKACBATM
SCHEMBL15730605 0.91 ATM (0.43) SRCPRKACAPRKACGPRKACBATM
SCHEMBL8299309 0.86 PDE4A (0.40) SRCPRKACAPRKACGPRKACBATM
SCHEMBL9501265 0.85 SRC (0.45) SRCPRKACAPRKACGPRKACBATM
SCHEMBL12657284 0.85 ATM (0.54) ATMPIM1PIM3PIM2HTR2A
SCHEMBL8520252 0.84 SRC (0.39) SRCPRKACAPRKACGPRKACBATM
SCHEMBL15680180 0.83 SRC (0.42) SRCPRKACAPRKACGPRKACBATM
SCHEMBL15255990 0.82 LMNA (0.46) SRCPRKACAPRKACGPRKACBATM
SCHEMBL4417847 0.82 ATM (0.52) ATMDAOPIM1PIM3PIM2
SCHEMBL8150276 0.80 SRC (0.52) SRCPRKACAPRKACGPRKACBHTR2A

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
CN-107260561-B Cosmetic and/or dermatological composition containing merocyanine derivatives 莱雅公司 2022-05-17 CN disclosed