SCHEMBL6673930

SCHEMBL6673930

Cn1cc(NC(=O)c2ccccc2-c2ccc(C(F)(F)F)cc2)cc1OC(=O)O

nearest known ligand 0.51

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MTTP P55157 16/20 0.51
APOB P04114 9/20 0.50
GAA P10253 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
KDM4E B2RXH2 1/20 0.47

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
SCHEMBL6673895 0.89 CHRNB2 (0.56) GAAKDM4E
SCHEMBL6675660 0.89 HTT (0.51) GAAKDM4E
SCHEMBL6677178 0.88 MTTP (0.47) MTTPAPOBGAASMN1; SMN2KDM4E
SCHEMBL6673887 0.87 L3MBTL1 (0.52) GAASMN1; SMN2KDM4E
SCHEMBL6675345 0.87 MTTP (0.49) MTTPAPOBGAASMN1; SMN2KDM4E
SCHEMBL6678823 0.87 MTTP (0.47) MTTPAPOBGAASMN1; SMN2
SCHEMBL6674929 0.86 MTTP (0.49) MTTPAPOBGAASMN1; SMN2KDM4E
SCHEMBL6680172 0.85 MTTP (0.46) MTTPAPOB
SCHEMBL6673783 0.84 MTTP (0.48) MTTPAPOBGAASMN1; SMN2KDM4E
SCHEMBL6278519 0.84 MTTP (0.55) MTTPAPOBGAASMN1; SMN2KDM4E

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
EP-1465613-A2 COMBINATION OF MTP INHIBITORS OR APOB SECRETION INHIBITORS WITH FIBRATES FOR USE AS DRUGS Boehringer Ingelheim Pharma GmbH & Co. KG (DE) 2004-10-13 EP disclosed
WO-2003057205-A2 COMBINATION OF MTP INHIBITORS OR APOB SECRETION INHIBITORS WITH FIBRATES FOR USE AS DRUGS BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2003-07-17 WO disclosed
WO-2003004020-A1 HETEROARYL CARBOXYLIC ACID AMIDES, THE PRODUCTION THEREOF AND THE USE OF THE SAME AS INHIBITORS OF THE MICROSOMAL TRIGLYCERIDE TRANSFER PROTEIN (MTP) BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2003-01-16 WO disclosed