SCHEMBL10885684

SCHEMBL10885684

CCCc1cc2ccccc2c(Oc2ccc(CC(=O)O)cc2)c1C(N)=O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 5/20 0.44
ESR2 Q92731 5/20 0.44
SRD5A2 P31213 2/20 0.41
AKR1B1 P15121 1/20 0.39
PPARG P37231 1/20 0.38
NR3C1 P04150 1/20 0.37
GPR84 Q9NQS5 1/20 0.37
ALDH1A1 P00352 3/20 0.36
HPGD P15428 2/20 0.36
HSD17B10 Q99714 2/20 0.36
PTGS1 P23219 1/20 0.36
AKR1C3 P42330 1/20 0.36
AKR1C2 P52895 1/20 0.36
MEN1 O00255 1/20 0.36
MAPT P10636 1/20 0.36
KMT2A Q03164 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
F2 P00734 1/20 0.36
KDM4E B2RXH2 1/20 0.36
THRA P10827 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
SCHEMBL10885694 0.81 PPARG (0.43) SRD5A2AKR1B1PPARGNR3C1ALDH1A1
SCHEMBL10885689 0.74 CTNNB1 (0.38) SRD5A2PPARGALDH1A1HPGDHSD17B10
SCHEMBL6237474 0.72 SRD5A2 (0.50) SRD5A2AKR1B1NR3C1ALDH1A1HPGD
SCHEMBL10603315 0.72 ESR1 (0.43) ESR1ESR2PPARGMEN1MAPT
SCHEMBL6239925 0.69 SRD5A2 (0.50) SRD5A2AKR1B1NR3C1ALDH1A1HPGD
SCHEMBL10704018 0.69 GPR84 (0.48) ESR1ESR2PPARGGPR84ALDH1A1
SCHEMBL10885686 0.69 LMNA (0.47) SRD5A2AKR1B1ALDH1A1MEN1MAPT
SCHEMBL6239365 0.69 SRD5A2 (0.49) SRD5A2AKR1B1NR3C1ALDH1A1HPGD
SCHEMBL6235731 0.67 SRD5A2 (0.64) SRD5A2AKR1B1PPARGNR3C1PTGS1
SCHEMBL28835732 0.67 TLR8 (0.47) PPARGGPR84ALDH1A1HPGDHSD17B10

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-0032286-B1 METHOD FOR ANALYSIS FOR A MEMBER OF AN IMMUNOLOGICAL PAIR USING A TEST SURFACE; KIT AND TEST SURFACE MATERIAL THEREFOR SYVA COMPANY (US) 1986-01-08 EP disclosed