SCHEMBL4010260

SCHEMBL4010260

CCOC(=O)Oc1c(OC(C)C)nc(-c2ccc(Cl)cc2)nc1C(C)C

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.45
MAPT P10636 4/20 0.42
ALDH1A1 P00352 2/20 0.42
LMNA P02545 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
RAB9A P51151 1/20 0.40
CYP1A2 P05177 2/20 0.38
POLB P06746 1/20 0.38
NPSR1 Q6W5P4 3/20 0.37
GAA P10253 1/20 0.37
GPR55 Q9Y2T6 1/20 0.37
TARBP2 Q15633 1/20 0.37
TRPM8 Q7Z2W7 1/20 0.36
GABRA2 P47869 1/20 0.35
GABRB2 P47870 1/20 0.35
SIRT2 Q8IXJ6 1/20 0.35
SIRT1 Q96EB6 1/20 0.35
SIRT3 Q9NTG7 1/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
CYP2D6 P10635 1/20 0.35

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
SCHEMBL4014170 0.87 MAPT (0.43) MAPTALDH1A1LMNATDP1RAB9A
SCHEMBL4008643 0.86 MAPT (0.46) MAPTALDH1A1LMNATDP1RAB9A
SCHEMBL4015164 0.85 ATM (0.52) ATMMAPTALDH1A1LMNATDP1
SCHEMBL4014101 0.84 ALDH1A1 (0.41) MAPTALDH1A1LMNATDP1RAB9A
SCHEMBL4010115 0.84 MAPT (0.39) ATMMAPTALDH1A1LMNATDP1
SCHEMBL8030927 0.82 ATM (0.46) ATMMAPTALDH1A1LMNATDP1
SCHEMBL4008512 0.79 MAPT (0.42) ATMMAPTALDH1A1LMNATDP1
SCHEMBL4011731 0.78 MAPT (0.41) MAPTALDH1A1LMNATDP1RAB9A
SCHEMBL4009770 0.76 MAPT (0.37) ATMMAPTALDH1A1LMNATDP1
SCHEMBL4015161 0.76 ATM (0.54) ATMALDH1A1TDP1RAB9APOLB

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