SCHEMBL8034289

SCHEMBL8034289

CCNc1nc(-c2ccc(Cl)cc2)nc(CC(C)C)c1C(=O)O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RXRA P19793 2/20 0.43
NR4A2 P43354 2/20 0.43
NPSR1 Q6W5P4 3/20 0.43
HPGD P15428 2/20 0.43
TSHR P16473 1/20 0.43
KDM4E B2RXH2 1/20 0.41
MAPT P10636 3/20 0.41
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
ALDH1A1 P00352 2/20 0.41
PDE10A Q9Y233 1/20 0.41
LMNA P02545 1/20 0.41
CRHBP P24387 1/20 0.41
HTT P42858 1/20 0.41
CRHR2 Q13324 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
TP53 P04637 1/20 0.39
NAMPT P43490 1/20 0.39
ADORA3 P0DMS8 3/20 0.39
CSNK2A2 P19784 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
SCHEMBL8047253 0.91 ACP1 (0.43) RXRANR4A2NPSR1HPGDTSHR
SCHEMBL8041741 0.89 NPSR1 (0.42) RXRANR4A2NPSR1HPGDTSHR
SCHEMBL8038572 0.87 NPSR1 (0.44) RXRANR4A2NPSR1HPGDTSHR
SCHEMBL8026809 0.86 MDM2 (0.43) RXRANR4A2NPSR1HPGDTSHR
SCHEMBL4007857 0.84 FABP3 (0.45) RXRANR4A2NPSR1HPGDTSHR
SCHEMBL8036843 0.83 RXRA (0.45) RXRANR4A2NPSR1HPGDTSHR
SCHEMBL8037126 0.81 PLA2G1B (0.41) RXRANR4A2NPSR1HPGDTSHR
SCHEMBL8040303 0.80 NPSR1 (0.42) NPSR1HPGDTSHRKDM4EMAPT
SCHEMBL8023453 0.79 RXRA (0.43) RXRANR4A2NPSR1HPGDTSHR
SCHEMBL8024898 0.79 MAPT (0.40) RXRANR4A2NPSR1HPGDTSHR

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-2009080242-A1 SUBSTITUTED 4-AMINOPYRIMIDINE-5-CARBOXYLIC ACID AND USE THEREOF BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2009-07-02 WO disclosed