SCHEMBL7702353

SCHEMBL7702353

CN(CCO)c1ccc(C2NCCc3ccccc32)cn1

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PRCP P42785 7/20 0.49
GID4 Q8IVV7 1/20 0.46
RECQL P46063 1/20 0.46
GAA P10253 1/20 0.46
MAPT P10636 3/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
ROCK2 O75116 1/20 0.36
TRPV1 Q8NER1 1/20 0.35
SLC22A1 O15245 1/20 0.35
TSHR P16473 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
POLB P06746 1/20 0.35

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
SCHEMBL7698245 0.84 PRCP (0.57) PRCPGID4RECQLGAAMAPT
SCHEMBL7699907 0.75 PRCP (0.66) PRCPGID4RECQLGAAMAPT
SCHEMBL7699909 0.75 PRCP (0.66) PRCPGID4RECQLGAAMAPT
SCHEMBL3066069 0.72 PRCP (0.66) PRCPGID4RECQLGAA
SCHEMBL7705935 0.72 PRCP (0.66) PRCPGID4RECQLGAA
SCHEMBL7702915 0.72 PRCP (0.57) PRCPGID4RECQLGAAMAPT
SCHEMBL7702912 0.72 PRCP (0.57) PRCPGID4RECQLGAAMAPT
SCHEMBL7700053 0.72 TRPM8 (0.35) PRCPTRPV1
SCHEMBL7702891 0.70 PRCP (0.52) PRCPGID4RECQLGAAMAPT
SCHEMBL7702893 0.70 PRCP (0.52) PRCPGID4RECQLGAAMAPT

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