SCHEMBL7220148

SCHEMBL7220148

CNC(=O)OC(c1nc(C)nc2c1COCN2c1c(C)cc(OC)cc1C)C(F)(F)F

nearest known ligand 0.31

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.31
MAPT P10636 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31

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
SCHEMBL7219383 0.92
SCHEMBL7225877 0.90
SCHEMBL7226518 0.85 KDM4E (0.31) KDM4EMAPTSMN1; SMN2
SCHEMBL7221841 0.74 CRHR1 (0.32)
SCHEMBL7220502 0.73 CRHR1 (0.32) KDM4EMAPTSMN1; SMN2
SCHEMBL7227988 0.62 CRHR1 (0.35)
SCHEMBL7227320 0.59 CRHR1 (0.44)
SCHEMBL7219519 0.59 CRHR1 (0.37) KDM4ESMN1; SMN2
SCHEMBL7219475 0.52 CRHR1 (0.44)
SCHEMBL29127366 0.51 ALDH1A1 (0.40) KDM4EMAPTSMN1; SMN2

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