SCHEMBL8604576

SCHEMBL8604576

CCN(CC(C)C)c1ccnc2c(-c3c(C)cc(C)cc3C)cc(C)n12

nearest known ligand 0.36

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CRHR1 P34998 10/20 0.36
LMNA P02545 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
SCHEMBL5805397 0.73 CRHR1 (0.43) CRHR1LMNA
SCHEMBL5788807 0.69 CRHR1 (0.46) CRHR1
SCHEMBL5788442 0.68 CRHR1 (0.52) CRHR1
SCHEMBL5786559 0.64 CRHR1 (0.43) CRHR1LMNA
SCHEMBL2868269 0.63 LMNA (0.31) CRHR1LMNA
SCHEMBL5785875 0.60 CRHR1 (0.41) CRHR1
SCHEMBL5788500 0.60 CRHR1 (0.46) CRHR1
SCHEMBL5788541 0.59 CRHR1 (0.58) CRHR1LMNA
SCHEMBL5788488 0.57 CRHR1 (0.55) CRHR1
SCHEMBL5788810 0.57 NPY1R (0.36) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0923582-A1 SUBSTITUTED 6,5-HETERO-BICYCLIC DERIVATIVES PFIZER INC. (US) 1999-06-23 EP disclosed
WO-1998008847-A1 SUBSTITUTED 6,5-HETERO-BICYCLIC DERIVATIVES PFIZER INC. (US) 1998-03-05 WO disclosed