SCHEMBL4715449

SCHEMBL4715449

Nc1ccc(N2CCCC2C(=O)O)cc1

nearest known ligand 0.45

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.44
MAPT P10636 1/20 0.43
BRS3 P32247 1/20 0.42
KMT2A Q03164 2/20 0.41
ALDH1A1 P00352 1/20 0.41
CA2 P00918 1/20 0.40
CHRNB2 P17787 1/20 0.40
CHRNB4 P30926 1/20 0.40
CHRNA3 P32297 1/20 0.40
CHRNA7 P36544 1/20 0.40
CHRNA4 P43681 1/20 0.40
FFAR1 O14842 3/20 0.40
PORCN Q9H237 2/20 0.39
CASP6 P55212 1/20 0.39
GFER P55789 1/20 0.39
HSD17B10 Q99714 1/20 0.39
THRB P10828 1/20 0.38
ALOX12 P18054 1/20 0.38

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
SCHEMBL13015198 0.90 GFER (0.41) MAPTBRS3KMT2AALDH1A1CASP6
SCHEMBL7035832 0.90 GFER (0.41) MAPTBRS3KMT2AALDH1A1CASP6
SCHEMBL77156 0.87 SYK (0.46) GFER
SCHEMBL13723813 0.87 SYK (0.46) GFER
SCHEMBL25262222 0.85 TDP1 (0.45) SMN1; SMN2MAPTBRS3KMT2AALDH1A1
SCHEMBL432319 0.84 SMN1; SMN2 (0.51) SMN1; SMN2MAPTKMT2AALDH1A1FFAR1
SCHEMBL15664724 0.84 SMN1; SMN2 (0.51) SMN1; SMN2MAPTKMT2AALDH1A1FFAR1
SCHEMBL630857 0.84 SMN1; SMN2 (0.51) SMN1; SMN2MAPTKMT2AALDH1A1FFAR1
SCHEMBL3060271 0.83 SMN1; SMN2 (0.44) SMN1; SMN2MAPTBRS3KMT2AALDH1A1
SCHEMBL9104214 0.83 FFAR1 (0.53) SMN1; SMN2MAPTFFAR1

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-0964864-B1 PYRIDO 2,3-D PYRIMIDINES AND 4-AMINOPYRIMIDINES AS INHIBITORS OF CELLULAR PROLIFERATION WARNER LAMBERT CO (US) 2008-04-09 EP disclosed