SCHEMBL7220577

SCHEMBL7220577

CCC(=NO)c1nc(C)nc2c1C(C)(O)C(=O)N2c1c(OC)cc(OC)cc1OC

nearest known ligand 0.32

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CRHR1 P34998 1/20 0.32
GAA P10253 2/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
ALDH1A1 P00352 1/20 0.30

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
SCHEMBL7220567 1.00 CRHR1 (0.32) CRHR1GAAMEN1KMT2AALDH1A1
SCHEMBL7227065 0.91
SCHEMBL7227070 0.91
SCHEMBL7219628 0.88 TSHR (0.36) CRHR1GAAMEN1KMT2AALDH1A1
SCHEMBL7219632 0.88 TSHR (0.36) CRHR1GAAMEN1KMT2AALDH1A1
SCHEMBL7227341 0.83
SCHEMBL7227339 0.83
SCHEMBL7222184 0.81
SCHEMBL7222180 0.81
SCHEMBL7228112 0.76 ALDH1A1 (0.33) CRHR1ALDH1A1

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-1103553-A2 Substituted heterocyclic derivatives Pfizer Products Inc. (US) 2001-05-30 EP claimed
US-6525067-B1 Corticotropin releasing factor antagonists; such as 1-(2-methyl-8-(2,4,6-trimethyl-phenyl)-quinolin-4-yl)-propan-1-one-oxime PFIZER INC 2003-02-25 US disclosed
EP-1103553-A2 Substituted heterocyclic derivatives Pfizer Products Inc. (US) 2001-05-30 EP disclosed