SCHEMBL4200648

SCHEMBL4200648

CCO/C=C\c1cnc(Cl)nc1[C](CC)CC

nearest known ligand 0.30

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.30
L3MBTL1 Q9Y468 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
SCHEMBL1233630 0.78 CSNK1A1 (0.37) ALDH1A1L3MBTL1
SCHEMBL1233615 0.78 CSNK1A1 (0.37) ALDH1A1L3MBTL1
SCHEMBL12984823 0.73 ALDH1A1 (0.35) ALDH1A1L3MBTL1
SCHEMBL12984819 0.73 ALDH1A1 (0.35) ALDH1A1L3MBTL1
SCHEMBL4526451 0.72 CRHR1 (0.37) ALDH1A1L3MBTL1
SCHEMBL4182956 0.72 CRHR1 (0.37) ALDH1A1L3MBTL1
SCHEMBL2199746 0.72 MEN1 (0.35)
SCHEMBL2199749 0.72 MEN1 (0.35)
SCHEMBL31093394 0.71
SCHEMBL10060438 0.71

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2029145-A2 PYRROLOPYRIMIDINE COMPOUNDS AND THEIR USES Novartis Ag (CH) 2009-03-04 EP disclosed
WO-2007140222-A2 PYRROLOPYRIMIDINE COMPOUNDS AND THEIR USES NOVARTIS AG (CH) 2007-12-06 WO disclosed