SCHEMBL7196025

SCHEMBL7196025

Cc1nc2ccc(OCC3(C)C=CC=CC3C(=O)O)cc2n1C(C)c1ncc(C(F)(F)F)cc1Cl

nearest known ligand 0.36

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.36
KMT2A Q03164 6/20 0.36
MEN1 O00255 5/20 0.36
GAA P10253 1/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
LMNA P02545 1/20 0.35
CYP1A2 P05177 1/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2C19 P33261 1/20 0.34
RECQL P46063 1/20 0.34
ALOX5AP P20292 6/20 0.34
HTT P42858 1/20 0.34
ALDH1A1 P00352 1/20 0.33
POLB P06746 1/20 0.33

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
SCHEMBL6920283 0.80 FFAR4 (0.41) MAPK1KMT2AMEN1GAASMN1; SMN2
SCHEMBL7196034 0.76 MRGPRX4 (0.41) MAPK1KMT2AMEN1POLB
SCHEMBL7192436 0.75 CYP1A2 (0.34) MAPK1KMT2AMEN1SMN1; SMN2CYP1A2
SCHEMBL7196713 0.73 PPARG (0.44) SMN1; SMN2LMNAALOX5AP
SCHEMBL7191526 0.71 ALDH1A1 (0.35) KMT2AMEN1GAASMN1; SMN2CYP1A2
SCHEMBL6922932 0.67 MAPK1 (0.41) MAPK1KMT2AMEN1GAASMN1; SMN2
SCHEMBL7193404 0.65 ALOX5AP (0.35) SMN1; SMN2LMNAALOX5AP
SCHEMBL6490952 0.63 ALOX5AP (0.43) KMT2AMEN1GAASMN1; SMN2ALOX5AP
SCHEMBL7196484 0.63 DCTPP1 (0.34) ALOX5AP
SCHEMBL9335318 0.62 MEN1 (0.38) MAPK1KMT2AMEN1CYP1A2CYP3A4

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
WO-2004108686-A2 BENZIMIDAZOLE COMPOUNDS HAVING HYPOGLYCEMIC ACTIVITY FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-12-16 WO disclosed