Sugi Predict

Sugi Predict / Compounds / SCHEMBL7703737

SCHEMBL7703737

SCHEMBL7703737

CN(C)c1nn(C)cc1C1c2ccccc2CCN1C=CC=O

nearest known ligand 0.36

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ PRCP P42785 3/20 0.36
▸ DRD1 P21728 1/20 0.31
▸ SMN1; SMN2 Q16637 1/20 0.30
▸ HHAT Q5VTY9 2/20 0.30
▸ SIGMAR1 Q99720 1/20 0.30

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
SCHEMBL7697839 0.77 PRCP (0.43) PRCPHHAT
SCHEMBL7704900 0.74 TRPM8 (0.37) PRCPHHAT
SCHEMBL7701133 0.74 PRCP (0.54) PRCPHHAT
SCHEMBL7706720 0.74 PRCP (0.38) PRCPDRD1SIGMAR1
SCHEMBL7705571 0.73 ALDH1A1 (0.35) PRCPSMN1; SMN2
SCHEMBL7702539 0.72 PRCP (0.46) PRCPHHAT
SCHEMBL7698116 0.72 TRPM8 (0.45) PRCPHHAT
SCHEMBL7705532 0.71 HHAT (0.37) PRCPHHATSIGMAR1
SCHEMBL7703888 0.71 PRCP (0.39) PRCPHHAT
SCHEMBL7705677 0.71 HHAT (0.37) PRCPHHATSIGMAR1

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-0901488-B1 2,4-DIAMINOPYRIMIDINE DERIVATIVES BASILEA PHARMACEUTICA AG (CH) 2002-11-06 — — EP disclosed
EP-0901488-A1 2,4-DIAMINOPYRIMIDINE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 1999-03-17 — — EP disclosed
WO-1997043277-A1 2,4-DIAMINOPYRIMIDINE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 1997-11-20 — — WO disclosed