SCHEMBL14446517

SCHEMBL14446517

CCOC(=O)c1c(C)nc2n(-c3c(C)cc(C)cc3C)c3ccccc3n12

nearest known ligand 0.60

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ CRHR1 P34998 15/20 0.60
▸ KMT2A Q03164 1/20 0.50
▸ MAPK1 P28482 1/20 0.44
▸ SMN1; SMN2 Q16637 1/20 0.44
▸ KDM4E B2RXH2 1/20 0.42

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
SCHEMBL5384064 0.89 CRHR1 (0.61) CRHR1KMT2AKDM4E
SCHEMBL5383687 0.87 CRHR1 (0.62) CRHR1KMT2AMAPK1SMN1; SMN2KDM4E
SCHEMBL14446523 0.86 CRHR1 (0.54) CRHR1
SCHEMBL5378452 0.86 CRHR1 (0.65) CRHR1
SCHEMBL5394100 0.81 GABRA2 (0.50) CRHR1KMT2AMAPK1SMN1; SMN2
SCHEMBL14446526 0.80 CRHR1 (0.63) CRHR1
SCHEMBL23494114 0.79 MAPK1 (0.51) KMT2AMAPK1SMN1; SMN2KDM4E
SCHEMBL5424675 0.77 CRHR1 (0.63) CRHR1KMT2ASMN1; SMN2KDM4E
SCHEMBL14446525 0.76 CRHR1 (0.52) CRHR1
SCHEMBL5378408 0.75 CRHR1 (1.00) 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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7244746-B2 Imidazolyl derivatives as corticotropin releasing factor inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2007-07-17 — — US disclosed
US-7244746-B2 Imidazolyl derivatives as corticotropin releasing factor inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2007-07-17 — — US disclosed
US-7238699-B2 Imidazolyl derivatives as corticotropin releasing factor inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2007-07-03 — — US disclosed
US-7238699-B2 Imidazolyl derivatives as corticotropin releasing factor inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2007-07-03 — — US disclosed
US-7211669-B2 Imidazolyl derivatives as corticotropin releasing factor inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2007-05-01 — — US disclosed
US-7211669-B2 Imidazolyl derivatives as corticotropin releasing factor inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2007-05-01 — — US disclosed
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