SCHEMBL7220674

SCHEMBL7220674

CC/C(=N\O)c1nc(C)nc2c1C(C)(O)C(=O)N2c1ccc(Cl)cc1Cl

nearest known ligand 0.35

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CRHR1 P34998 2/20 0.35
MEN1 O00255 1/20 0.34
MAPT P10636 1/20 0.34
ALOX12 P18054 1/20 0.34
KMT2A Q03164 1/20 0.34
GABRA2 P47869 5/20 0.34
GABRB2 P47870 5/20 0.34
ALDH1A1 P00352 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
CNR2 P34972 3/20 0.33
CNR1 P21554 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
SCHEMBL7220677 1.00 CRHR1 (0.35) CRHR1MEN1MAPTALOX12KMT2A
SCHEMBL7228112 0.93 ALDH1A1 (0.33) CRHR1ALDH1A1
SCHEMBL7228114 0.93 ALDH1A1 (0.33) CRHR1ALDH1A1
SCHEMBL7222184 0.85
SCHEMBL7222180 0.85
SCHEMBL7219632 0.80 TSHR (0.36) CRHR1MEN1MAPTKMT2AALDH1A1
SCHEMBL7219628 0.80 TSHR (0.36) CRHR1MEN1MAPTKMT2AALDH1A1
SCHEMBL7227341 0.79
SCHEMBL7227339 0.79
SCHEMBL7220577 0.75 CRHR1 (0.32) CRHR1MEN1KMT2AALDH1A1

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