SCHEMBL6428277

SCHEMBL6428277

CCOC(c1cc(C)nc(Oc2ccccc2C)c1C)C(F)(F)F

nearest known ligand 0.44

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.41
HPGD P15428 1/20 0.41
KMT2A Q03164 1/20 0.41
CRHR1 P34998 2/20 0.37
ALDH1A1 P00352 1/20 0.34
MAPT P10636 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34

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
SCHEMBL5844014 0.63 CRHR1 (0.57) CRHR1
SCHEMBL31280713 0.62 KDM4E (0.38)
SCHEMBL6446320 0.62 CRHR1 (0.47) MEN1KMT2ACRHR1
SCHEMBL13677216 0.62 FFAR1 (0.44) HPGDNPSR1
SCHEMBL8993442 0.62 MEN1 (0.53) MEN1HPGDKMT2AALDH1A1NPSR1
SCHEMBL5844373 0.61 CRHR1 (0.49) CRHR1
SCHEMBL5846010 0.61 CRHR1 (0.78) CRHR1
Propane SCHEMBL28061941 0.60 TSHR (0.58) MEN1HPGDKMT2AALDH1A1
SCHEMBL5843396 0.59 CRHR1 (0.39) CRHR1
Ether SCHEMBL7455606 0.59 TSHR (0.52) MEN1KMT2AALDH1A1

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
US-6844351-B1 Corticotropin releasing factor antagonists PFIZER INC. (US) 2005-01-18 US disclosed