SCHEMBL7441817

SCHEMBL7441817

Cc1cc(CCCNCC2CC2)n2nc(C)c(-c3ccc(Cl)cc3C)c2n1

nearest known ligand 0.52

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CRHR1 P34998 17/20 0.52
ALDH1A1 P00352 2/20 0.39
KDM4E B2RXH2 1/20 0.39
HPGD P15428 1/20 0.39
MAPT P10636 2/20 0.39
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38

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
SCHEMBL7429887 0.93 CRHR1 (0.56) CRHR1
SCHEMBL7438143 0.90 CRHR1 (0.42) CRHR1KDM4EMAPTMEN1KMT2A
SCHEMBL5600453 0.81 CRHR1 (0.50) CRHR1
SCHEMBL7441810 0.74 CRHR1 (0.52) CRHR1ALDH1A1KDM4EHPGDMAPT
SCHEMBL5599676 0.74 CRHR1 (0.58) CRHR1
SCHEMBL5600448 0.72 CRHR1 (0.86) CRHR1
SCHEMBL5600230 0.71 CRHR1 (0.41) CRHR1
SCHEMBL5600460 0.71 CRHR1 (0.52) CRHR1ALDH1A1KDM4EHPGDMAPT
SCHEMBL27670939 0.69 CRHR1 (0.52) CRHR1ALDH1A1KDM4EHPGDMAPT
SCHEMBL5599786 0.68 CRHR1 (0.74) 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-1149583-A2 Combinations of corticotropin releasing factor antagonists and growth hormone secretagogues Pfizer Products Inc. (US) 2001-10-31 EP claimed