SCHEMBL13889741

SCHEMBL13889741

Cc1sc(C)c(C2=C(c3c(C)n(C)c4ccccc34)CCC2)c1C

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.37
▸ MEN1 O00255 4/20 0.37
▸ KMT2A Q03164 4/20 0.37
▸ HPGD P15428 3/20 0.37
▸ LMNA P02545 2/20 0.37
▸ MAPT P10636 2/20 0.37
▸ KDM4E B2RXH2 5/20 0.36
▸ HSD17B10 Q99714 2/20 0.36
▸ GLA P06280 1/20 0.36
▸ GAA P10253 1/20 0.36
▸ CYP2C19 P33261 1/20 0.36
▸ HTT P42858 1/20 0.36
▸ GPR3 P46089 1/20 0.36
▸ THRB P10828 2/20 0.35
▸ RECQL P46063 1/20 0.35
▸ NPSR1 Q6W5P4 2/20 0.35
▸ HTR2A P28223 1/20 0.35
▸ HTR2C P28335 1/20 0.35
▸ ALOX15 P16050 1/20 0.34
▸ MAPK1 P28482 1/20 0.34

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
SCHEMBL13889737 0.87 GPR3 (0.47) ALDH1A1MEN1KMT2AHPGDLMNA
SCHEMBL13889738 0.85 MEN1 (0.39) ALDH1A1MEN1KMT2AHPGDLMNA
SCHEMBL14522095 0.76 PLA2G10 (0.36) ALDH1A1MEN1KMT2AHPGDLMNA
SCHEMBL1821743 0.75 GSK3B (0.41) ALDH1A1MEN1KMT2AHPGDLMNA
SCHEMBL13889739 0.68 GAA (0.43) ALDH1A1MEN1KMT2AHPGDMAPT
SCHEMBL29634190 0.67 KMT2A (0.54) ALDH1A1MEN1KMT2AHPGDLMNA
SCHEMBL5054625 0.66 GPR3 (0.41) ALDH1A1MEN1KMT2AHPGDLMNA
SCHEMBL483003 0.65 GPR3 (0.61) ALDH1A1MEN1KMT2AHPGDMAPT
SCHEMBL31132408 0.65 GPR3 (0.61) ALDH1A1MEN1KMT2AHPGDMAPT
SCHEMBL18392178 0.65 KDM4E (0.61) ALDH1A1MEN1KMT2AHPGDLMNA

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-7524605-B2 Lithographic printing plate precursor and lithographic printing method FUJIFILM CORPORATION (JP) 2009-04-28 — — US disclosed
US-7524605-B2 Lithographic printing plate precursor and lithographic printing method FUJIFILM CORPORATION (JP) 2009-04-28 — — US disclosed
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