SCHEMBL9259956

SCHEMBL9259956

CCC(=O)Oc1nccc(CC)c1NC(=O)C1CCCCC1C(=O)Nc1ccc(C=NN)cc1

nearest known ligand 0.40

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.37
HTT P42858 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
KDM4E B2RXH2 1/20 0.35
CYP2C19 P33261 1/20 0.35
RAB9A P51151 3/20 0.35
POLB P06746 2/20 0.33
FNTA P49354 1/20 0.33
FNTB P49356 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
SCHEMBL9259952 0.84 CYP2C19 (0.41) LMNAHTTSMN1; SMN2KDM4ECYP2C19
SCHEMBL9260010 0.78 POLB (0.35) SMN1; SMN2RAB9APOLB
SCHEMBL7361744 0.72 RAB9A (0.62) LMNAHTTSMN1; SMN2KDM4ECYP2C19
SCHEMBL9425991 0.68 KLK5 (0.40) CYP2C19RAB9A
SCHEMBL6979118 0.68 ALDH1A1 (0.33) SMN1; SMN2RAB9APOLB
SCHEMBL9559013 0.67 GAA (0.44) LMNAHTTSMN1; SMN2KDM4ECYP2C19
SCHEMBL9559001 0.67 LMNA (0.42) LMNAHTTSMN1; SMN2KDM4ECYP2C19
SCHEMBL9257997 0.67 GAA (0.37) LMNAHTTSMN1; SMN2KDM4ECYP2C19
SCHEMBL9559016 0.66 GAA (0.42) LMNAHTTSMN1; SMN2KDM4ECYP2C19
SCHEMBL9559004 0.66 LMNA (0.42) LMNAKDM4ERAB9AFNTAFNTB

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
US-5378727-A ADMINISTERING TO MAMMALS G. D. SEARLE & CO. (US) 1995-01-03 US disclosed
US-5254573-A Substituted heterocyclic derivatives useful as platelet aggregation inhibitors MONSANTO COMPANY (US) 1993-10-19 US disclosed
EP-0539343-A1 Substituted heterocyclic derivatives useful as platelet aggregation inhibitors MONSANTO COMPANY (US) 1993-04-28 EP disclosed