SCHEMBL10587406

SCHEMBL10587406

C=CCc1c(O)cccc1-c1cccc(O)c1CC=C

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 4/20 0.53
GABRB2 P47870 4/20 0.53
AKR1B1 P15121 2/20 0.45
MEN1 O00255 5/20 0.44
KMT2A Q03164 5/20 0.44
MAPT P10636 5/20 0.44
ALDH1A1 P00352 4/20 0.44
GAA P10253 3/20 0.44
KDM4E B2RXH2 3/20 0.44
HPGD P15428 3/20 0.44
CNR1 P21554 2/20 0.44
CNR2 P34972 2/20 0.44
ALDH2 P05091 1/20 0.44
PPARG P37231 1/20 0.44
PPARD Q03181 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
SRD5A1 P18405 1/20 0.42
XDH P47989 1/20 0.41
TNKS O95271 1/20 0.37
PARP1 P09874 1/20 0.37

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
SCHEMBL1354945 0.94 GABRA1 (0.48) GABRA1GABRB2AKR1B1MEN1KMT2A
SCHEMBL69556 0.89 GABRA1 (0.48) GABRA1GABRB2AKR1B1MEN1KMT2A
SCHEMBL4987129 0.87 ALDH1A1 (0.50) GABRA1GABRB2AKR1B1MEN1KMT2A
SCHEMBL6690960 0.83 GABRA1 (0.44) GABRA1GABRB2AKR1B1MEN1KMT2A
SCHEMBL21295457 0.82 PNMT (0.46) GABRA1GABRB2AKR1B1MAPT
SCHEMBL6013229 0.82 GABRA1 (0.52) GABRA1GABRB2AKR1B1MEN1KMT2A
SCHEMBL9620573 0.81 GABRA1 (0.42) GABRA1GABRB2AKR1B1MEN1KMT2A
SCHEMBL4931545 0.81 GABRA1 (0.42) GABRA1GABRB2AKR1B1MEN1KMT2A
SCHEMBL254084 0.81 GABRA1 (0.57) GABRA1GABRB2AKR1B1MEN1KMT2A
SCHEMBL2909587 0.80 GABRA1 (0.43) GABRA1GABRB2AKR1B1MEN1KMT2A

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-0318868-A1 Maleimide-based thermosettable resin compositions HERCULES INCORPORATED (US) 1989-06-07 EP claimed