SCHEMBL15876151

SCHEMBL15876151

Cc1sc(C(=O)O)c2ccccc12

nearest known ligand 0.48

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 3/20 0.48
SMN1; SMN2 Q16637 2/20 0.46
PRNP P04156 1/20 0.45
RXFP1 Q9HBX9 1/20 0.45
KDM4E B2RXH2 2/20 0.40
KMT2A Q03164 1/20 0.40
RARA P10276 1/20 0.40
RARB P10826 1/20 0.40
RARG P13631 1/20 0.40
BCL2L1 Q07817 1/20 0.40
GPR35 Q9HC97 1/20 0.39
MYC P01106 1/20 0.39
PDE10A Q9Y233 1/20 0.39
DAO P14920 1/20 0.39
RECQL P46063 1/20 0.39
RAB9A P51151 1/20 0.39
PTPN2 P17706 1/20 0.38
PTPN1 P18031 1/20 0.38
HPGD P15428 1/20 0.38

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
SCHEMBL120570 0.75 CYP1A2 (0.47) SMN1; SMN2KDM4E
SCHEMBL11328828 0.74 MCL1 (0.48) MCL1SMN1; SMN2PRNPRXFP1KDM4E
SCHEMBL14246796 0.74 MCL1 (0.48) MCL1SMN1; SMN2PRNPRXFP1KDM4E
SCHEMBL7970697 0.74 MCL1 (0.58) MCL1SMN1; SMN2PRNPRXFP1KDM4E
SCHEMBL584871 0.74 RXFP1 (0.71) MCL1PRNPRXFP1KDM4EKMT2A
SCHEMBL29939764 0.74 RXFP1 (0.71) MCL1PRNPRXFP1KDM4EKMT2A
SCHEMBL11730019 0.72 RXFP1 (0.47) MCL1SMN1; SMN2PRNPRXFP1KDM4E
SCHEMBL5852644 0.71 ALDH1A1 (0.65) SMN1; SMN2KMT2ARECQLHPGD
SCHEMBL29448323 0.69 PRNP (0.53) MCL1PRNPRXFP1KDM4EKMT2A
SCHEMBL1398747 0.69 PRNP (0.53) MCL1PRNPRXFP1KDM4EKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107325002-B Method for synthesizing aryl halide by taking aryl carboxylic acid as raw material 南昌大学 2020-03-27 CN disclosed
WO-2014111493-A1 SUBSTITUTED BENZIMIDAZOLYL PHOSPHINE COMPOUNDS AND A METHOD FOR DECARBOXYLATING CARBON-CARBON LINKING SALTIGO GMBH (DE) 2014-07-24 WO disclosed
EP-2757106-A1 Substituted benzimidazole phosphine compounds and a method for decarboxylating carbon-carbon bond Saltigo GmbH (DE) 2014-07-23 EP disclosed