SCHEMBL7705935

SCHEMBL7705935

Clc1ccc([C@H]2NCCc3ccccc32)cn1

nearest known ligand 0.66

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PRCP P42785 6/20 0.66
GAA P10253 1/20 0.58
RECQL P46063 1/20 0.57
GID4 Q8IVV7 1/20 0.54
CHRNB2 P17787 2/20 0.48
CHRNA4 P43681 2/20 0.48
CHRNB4 P30926 1/20 0.44
CHRNA3 P32297 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
SCHEMBL3066069 1.00 PRCP (0.66) PRCPGAARECQLGID4CHRNB2
SCHEMBL7699909 0.82 PRCP (0.66) PRCPGAARECQLGID4
SCHEMBL7699907 0.82 PRCP (0.66) PRCPGAARECQLGID4
SCHEMBL21063715 0.80 PRCP (1.00) PRCPGAARECQLGID4
SCHEMBL30973226 0.80 PRCP (1.00) PRCPGAARECQLGID4
SCHEMBL3072702 0.80 PRCP (1.00) PRCPGAARECQLGID4
SCHEMBL7702915 0.79 PRCP (0.57) PRCPGAARECQLGID4
SCHEMBL3063503 0.79 PRCP (0.57) PRCPGAARECQLGID4
SCHEMBL7698245 0.79 PRCP (0.57) PRCPGAARECQLGID4
SCHEMBL7702912 0.79 PRCP (0.57) PRCPGAARECQLGID4

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 4 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
US-5866583-A Substituted 2,4-diaminopyrimidines HOFFMANN-LA ROCHE INC. (US) 1999-02-02 US disclosed
WO-1997043277-A1 2,4-DIAMINOPYRIMIDINE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 1997-11-20 WO disclosed