SCHEMBL6442923

SCHEMBL6442923

CC(=Cc1ccccc1)c1ccc(O)c(C(C)=Cc2ccccc2)c1C(C)=Cc1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.41
TSHR P16473 1/20 0.41
AKR1C3 P42330 1/20 0.41
NISCH Q9Y2I1 1/20 0.39
FBP1 P09467 1/20 0.38
DHODH Q02127 1/20 0.37
TRPM8 Q7Z2W7 1/20 0.37
ESR1 P03372 2/20 0.37
ESR2 Q92731 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
KDM1A O60341 1/20 0.36
RECQL P46063 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
BRD4 O60885 1/20 0.35
CREBBP Q92793 1/20 0.35
HTT P42858 1/20 0.35
PTPN1 P18031 1/20 0.35
HNF4A P41235 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
SCHEMBL7756202 0.80 ALDH1A1 (0.47) ALDH1A1TSHRAKR1C3NISCHFBP1
SCHEMBL9393740 0.80 ALDH1A1 (0.47) ALDH1A1TSHRAKR1C3NISCHFBP1
SCHEMBL30495367 0.79 MAPT (0.47) ALDH1A1TSHRAKR1C3NISCHFBP1
SCHEMBL11203024 0.79 MAPT (0.47) ALDH1A1TSHRAKR1C3NISCHFBP1
SCHEMBL10973737 0.79 MAPT (0.47) ALDH1A1TSHRAKR1C3NISCHFBP1
SCHEMBL7059289 0.78 ALDH1A1 (0.41) ALDH1A1TSHRAKR1C3NISCHFBP1
SCHEMBL7715071 0.78 TSHR (0.52) ALDH1A1TSHRAKR1C3NISCHFBP1
SCHEMBL29177862 0.75 L3MBTL1 (0.44) ALDH1A1TSHRAKR1C3NISCHFBP1
SCHEMBL30332525 0.75 L3MBTL1 (0.44) ALDH1A1TSHRAKR1C3NISCHFBP1
SCHEMBL3668138 0.75 CSNK2A1 (0.50) MEN1KMT2APTPN1HNF4A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6855330-B2 Insecticide suspension concentrates BAYER AKTIENGESELLSCHAFT (DE) 2005-02-15 US disclosed
US-5950360-A Use of gel formulations as dressing agents for plant seed BAYER AKTIENGESELLSCHAFT (DE) 1999-09-14 US disclosed