SCHEMBL5772334

SCHEMBL5772334

Cc1nc(N2CCCCC2)c2sc(-c3ccc(F)cc3)cc2n1

nearest known ligand 0.78

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
NPY5R Q15761 14/20 0.78
PRKCI P41743 3/20 0.45
KCNH2 Q12809 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.44
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44

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
Hydrochloric Acid SCHEMBL5773169 0.98 NPY5R (0.74) NPY5RPRKCIKCNH2SMN1; SMN2MEN1
SCHEMBL5771155 0.88 NPY5R (0.78) NPY5RPRKCISMN1; SMN2MEN1KMT2A
SCHEMBL5773316 0.88 NPY5R (1.00) NPY5RPRKCISMN1; SMN2MEN1KMT2A
Hydrochloric Acid SCHEMBL5773817 0.87 NPY5R (0.76) NPY5RPRKCISMN1; SMN2MEN1KMT2A
Hydrochloric Acid SCHEMBL5774363 0.86 NPY5R (0.97) NPY5RPRKCISMN1; SMN2MEN1KMT2A
SCHEMBL22727925 0.77 NPY5R (0.65) NPY5RPRKCI
SCHEMBL5774720 0.73 NPY5R (1.00) NPY5R
SCHEMBL5772009 0.73 MEN1 (0.67) NPY5RSMN1; SMN2MEN1KMT2A
SCHEMBL5772205 0.72 NPY5R (0.69) NPY5RPRKCIKCNH2SMN1; SMN2
SCHEMBL5776579 0.72 NPY5R (0.72) NPY5RPRKCISMN1; SMN2MEN1KMT2A

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
EP-1054887-B1 BICYCLIC PYRIDINE AND PYRIMIDINE DERIVATIVES AS NEUROPEPTIDE Y RECEPTOR ANTAGONISTS AMGEN INC (US) 2006-04-12 EP claimed