SCHEMBL1258491

SCHEMBL1258491

C=C(C)Cc1cccc(-c2cccc(CC(=C)C)c2O)c1O

nearest known ligand 0.52

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ GABRA1 P14867 3/20 0.52
▸ GABRB2 P47870 3/20 0.52
▸ AKR1B1 P15121 1/20 0.37
▸ ALDH1A1 P00352 2/20 0.36
▸ IAPP P10997 2/20 0.35
▸ PDCD1 Q15116 1/20 0.33
▸ CD274 Q9NZQ7 1/20 0.33
▸ PTPN5 P54829 2/20 0.33
▸ HMGB1 P09429 1/20 0.31
▸ ANPEP P15144 1/20 0.30
▸ DPP4 P27487 1/20 0.30
▸ ELANE P08246 1/20 0.30
▸ IDO1 P14902 1/20 0.30
▸ DUSP3 P51452 1/20 0.30
▸ PTPN11 Q06124 1/20 0.30
▸ CTDSP1 Q9GZU7 1/20 0.30

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
SCHEMBL11061615 0.89 GABRA1 (0.52) GABRA1GABRB2AKR1B1ALDH1A1IAPP
SCHEMBL8389267 0.83 IAPP (0.52) GABRA1GABRB2AKR1B1ALDH1A1IAPP
SCHEMBL10437334 0.82 PTPN5 (0.43) GABRA1GABRB2AKR1B1PDCD1CD274
SCHEMBL20906311 0.82 GABRA1 (0.45) GABRA1GABRB2ALDH1A1IAPPPDCD1
SCHEMBL5785094 0.82 ALDH1A1 (0.50) GABRA1GABRB2ALDH1A1
SCHEMBL19510859 0.80 GABRA1 (0.39) GABRA1GABRB2IAPPIDO1
SCHEMBL2050223 0.80 HSP90AA1 (0.47) GABRA1GABRB2AKR1B1
SCHEMBL10735838 0.80 EGFR (0.39) GABRA1GABRB2IAPPIDO1
SCHEMBL5787969 0.77 IDO1 (0.56) ALDH1A1IDO1
SCHEMBL28473757 0.77 ERN1 (0.50) GABRA1GABRB2ALDH1A1IAPP

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
US-20110042124-A1 MULTILAYER WIRING SUBSTRATE HAVING CAVITY PORTION MITSUBISHI PLASTICS, INC. (JP) 2011-02-24 — — US disclosed
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