SCHEMBL7809447

SCHEMBL7809447

Cc1ccc(Nc2cccc(N3CCOCC3)c2)cc1NC(=O)c1cccc(OC2CCCN(C)CC2)c1

nearest known ligand 0.56

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
OPRK1 P41145 2/20 0.56
MAPK14 Q16539 14/20 0.52
SMO Q99835 1/20 0.49
CSF1R P07333 2/20 0.46
NTRK1 P04629 1/20 0.44
KDR P35968 1/20 0.43

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
SCHEMBL6476455 0.94 OPRK1 (0.61) OPRK1MAPK14SMOCSF1RKDR
SCHEMBL7807945 0.88 OPRK1 (0.56) OPRK1MAPK14SMONTRK1
SCHEMBL7804552 0.86 OPRK1 (0.54) OPRK1MAPK14SMONTRK1
SCHEMBL7806472 0.85 OPRK1 (0.51) OPRK1MAPK14SMONTRK1
SCHEMBL6978609 0.84 MAPK14 (0.68) MAPK14SMOCSF1R
SCHEMBL7805580 0.83 MAPK14 (0.56) OPRK1MAPK14SMOCSF1RNTRK1
SCHEMBL7780464 0.83 MAPK14 (0.65) MAPK14SMO
SCHEMBL6476258 0.82 OPRK1 (0.62) OPRK1MAPK14SMOCSF1RNTRK1
SCHEMBL7856914 0.82 MAPK14 (0.70) MAPK14
SCHEMBL6979521 0.82 MAPK14 (0.58) OPRK1MAPK14SMOCSF1R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1077931-A1 BENZAMIDE DERIVATIVES FOR THE TREATMENT OF DISEASES MEDIATED BY CYTOKINES AstraZeneca AB (SE) 2001-02-28 EP disclosed
WO-1999059959-A1 BENZAMIDE DERIVATIVES FOR THE TREATMENT OF DISEASES MEDIATED BY CYTOKINES ASTRAZENECA AB (SE) 1999-11-25 WO disclosed