SCHEMBL7105875

SCHEMBL7105875

CCC(CCCCl)Nc1ccnc(Oc2c(C)cc(C)cc2C)c1C

nearest known ligand 0.55

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CRHR1 P34998 4/20 0.55

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
Hydrochloric Acid SCHEMBL3103251 0.72 CRHR1 (0.95) CRHR1
SCHEMBL123421 0.71 CRHR1 (1.00) CRHR1
SCHEMBL30397878 0.71 CRHR1 (1.00) CRHR1
Hydrochloric Acid SCHEMBL5844378 0.70 CRHR1 (0.70) CRHR1
Hydrochloric Acid SCHEMBL3103253 0.70 CRHR1 (0.97) CRHR1
SCHEMBL5844563 0.70 CRHR1 (0.73) CRHR1
SCHEMBL5844501 0.70 CRHR1 (0.65) CRHR1
Hydrochloric Acid SCHEMBL5844382 0.69 CRHR1 (0.72) CRHR1
SCHEMBL6428305 0.69 CRHR1 (0.44) CRHR1
SCHEMBL5844686 0.68 CRHR1 (0.86) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0920429-B1 SUBSTITUTED PYRIDO- OR PYRIMIDO-CONTAINING 6,6- OR 6,7-BICYCLIC DERIVATIVES PFIZER (US) 2003-02-19 EP disclosed
EP-0920429-A1 SUBSTITUTED PYRIDO- OR PYRIMIDO-CONTAINING 6,6- OR 6,7-BICYCLIC DERIVATIVES PFIZER INC. (US) 1999-06-09 EP disclosed
WO-1998005661-A1 SUBSTITUTED PYRIDO- OR PYRIMIDO-CONTAINING 6,6- OR 6,7-BICYCLIC DERIVATIVES PFIZER INC. (US) 1998-02-12 WO disclosed