SCHEMBL8038397

SCHEMBL8038397

CCCc1nc(-c2ccc(Cl)cc2)nc(CCC)c1C(=O)OCC

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TARBP2 Q15633 1/20 0.49
MAPT P10636 3/20 0.48
PRKCZ Q05513 1/20 0.48
TRPM8 Q7Z2W7 1/20 0.48
RAB9A P51151 2/20 0.47
TP53 P04637 2/20 0.47
GABRA2 P47869 2/20 0.47
GABRB2 P47870 2/20 0.47
MDM2 Q00987 1/20 0.47
SIRT2 Q8IXJ6 1/20 0.46
SIRT1 Q96EB6 1/20 0.46
SIRT3 Q9NTG7 1/20 0.46
KDM4E B2RXH2 2/20 0.46
ALPL P05186 1/20 0.46
HSD17B10 Q99714 1/20 0.46
LMNA P02545 2/20 0.45
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
GLA P06280 1/20 0.45
MAPK1 P28482 1/20 0.45

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
SCHEMBL8032185 0.88 LMNA (0.45) TARBP2MAPTPRKCZTRPM8RAB9A
SCHEMBL8037054 0.86 KDM4E (0.50) TARBP2MAPTPRKCZTRPM8RAB9A
SCHEMBL8036404 0.85 CYP1A2 (0.43) TARBP2MAPTPRKCZTRPM8RAB9A
SCHEMBL8034697 0.84 MAPT (0.40) TARBP2MAPTPRKCZTRPM8RAB9A
SCHEMBL8034254 0.83 LMNA (0.42) TARBP2MAPTPRKCZTRPM8RAB9A
SCHEMBL8040307 0.83 GABRA2 (0.49) TARBP2MAPTPRKCZTRPM8RAB9A
SCHEMBL8032162 0.80 SIRT2 (0.52) TARBP2MAPTPRKCZTRPM8TP53
SCHEMBL4007701 0.80 CTRC (0.41) MAPTRAB9ATP53KDM4EMEN1
SCHEMBL8036018 0.80 KDM4E (0.56) TARBP2MAPTPRKCZTRPM8RAB9A
SCHEMBL11494053 0.78 KDM4E (0.73) MAPTRAB9ATP53KDM4EHSD17B10

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
WO-2009080248-A1 SUBSTITUTED 2-PHENYLPYRIMIDINE-5-CARBOXYLIC ACIDS AND THE USE THEREOF BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2009-07-02 WO disclosed