SCHEMBL11904530

SCHEMBL11904530

COCc1cc(OC)c(-c2csc3c(NC(=O)O)c(SC)nn23)c(OC)c1

nearest known ligand 0.51

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CRHR1 P34998 20/20 0.51

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
SCHEMBL11920853 0.88 CRHR1 (0.50) CRHR1
SCHEMBL3103128 0.87 CRHR1 (0.60) CRHR1
SCHEMBL3107787 0.81 CRHR1 (0.55) CRHR1
SCHEMBL1613290 0.79 CRHR1 (0.57) CRHR1
SCHEMBL3107036 0.78 CRHR1 (0.56) CRHR1
SCHEMBL11904388 0.76 CRHR1 (0.46) CRHR1
SCHEMBL11903721 0.75 CRHR1 (0.65) CRHR1
SCHEMBL3231469 0.75 CRHR1 (0.63) CRHR1
SCHEMBL12693248 0.75 CRHR1 (0.55) CRHR1
SCHEMBL1613443 0.75 CRHR1 (0.71) CRHR1

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
EP-2487178-A1 PYRAZOLOTHIAZOLE COMPOUND Eisai R&D Management Co., Ltd. (JP) 2012-08-15 EP disclosed