SCHEMBL8900698

SCHEMBL8900698

CCOC(=O)c1[c]ccc(C(=O)c2ccc(C)cc2)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 3/20 0.47
ALDH1A1 P00352 2/20 0.47
HPGD P15428 1/20 0.47
LMNA P02545 2/20 0.46
GAA P10253 1/20 0.43
KMT2A Q03164 1/20 0.43
CA12 O43570 2/20 0.42
CA1 P00915 2/20 0.42
CA2 P00918 2/20 0.42
CA7 P43166 2/20 0.42
CA9 Q16790 2/20 0.42
CA14 Q9ULX7 2/20 0.42
ESR1 P03372 1/20 0.41
ESR2 Q92731 1/20 0.41
SRD5A2 P31213 2/20 0.41
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
MAOA P21397 1/20 0.41
NPC1 O15118 1/20 0.40
USP2 O75604 1/20 0.40

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
SCHEMBL128776 0.85 CA12 (0.53) RAB9AALDH1A1LMNAKMT2ACA12
SCHEMBL11833488 0.80 TSHR (0.44) RAB9AALDH1A1HPGDLMNAGAA
SCHEMBL6426350 0.75 CA12 (0.51) HPGDLMNAGAACA12CA1
SCHEMBL9187932 0.74 TSHR (0.44) RAB9AALDH1A1HPGDLMNAKMT2A
SCHEMBL11839343 0.74 ALOX15 (0.46) ALDH1A1HPGDKMT2ACA12CA1
SCHEMBL5394487 0.74 LMNA (0.39) RAB9AALDH1A1LMNAGAAKMT2A
SCHEMBL6950385 0.73 LMNA (0.53) ALDH1A1HPGDLMNAKMT2AESR1
SCHEMBL27470832 0.73 HPGD (0.47) RAB9AALDH1A1HPGDLMNAGAA
SCHEMBL6788089 0.72 CA1 (0.73) RAB9AALDH1A1HPGDLMNAKMT2A
SCHEMBL235800 0.72 CA2 (0.73) RAB9AALDH1A1HPGDLMNAGAA

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-0764673-A2 Process for the production of polycarbonate TEIJIN LIMITED (JP) 1997-03-26 EP disclosed