SCHEMBL10060201

SCHEMBL10060201

COC(=O)c1cc(C(=O)OC)cc(N(C)/N=C(/C(C)=O)C(=O)Nc2ccccc2OCCO)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.43
HPGD P15428 2/20 0.43
NPSR1 Q6W5P4 1/20 0.43
TDP1 Q9NUW8 2/20 0.39
CASP6 P55212 1/20 0.39
KMT2A Q03164 6/20 0.38
MAPT P10636 4/20 0.37
RAB9A P51151 2/20 0.37
MEN1 O00255 2/20 0.37
ALDH1A1 P00352 3/20 0.37
HSD17B10 Q99714 3/20 0.37
TSHR P16473 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.35
LMNA P02545 1/20 0.35
GAA P10253 3/20 0.35
KCNH2 Q12809 2/20 0.35
KDM4E B2RXH2 2/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
NPC1 O15118 1/20 0.34
CREBBP Q92793 1/20 0.34

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
SCHEMBL10060119 0.82 POLB (0.49) POLBHPGDNPSR1TDP1CASP6
SCHEMBL764899 0.78 ALDH1A1 (0.49) POLBHPGDTDP1CASP6KMT2A
SCHEMBL12998588 0.74 MAPT (0.55) POLBTDP1CASP6KMT2AMAPT
SCHEMBL765365 0.74 MAPT (0.55) POLBTDP1CASP6KMT2AMAPT
SCHEMBL13679873 0.73 ALDH1A1 (0.42) POLBHPGDNPSR1TDP1CASP6
SCHEMBL15943552 0.72 MAPT (0.49) POLBNPSR1TDP1CASP6KMT2A
SCHEMBL14626257 0.72 KMT2A (0.46) POLBTDP1CASP6KMT2AMAPT
SCHEMBL15943537 0.71 ALDH1A1 (0.43) POLBHPGDTDP1CASP6KMT2A
SCHEMBL10060120 0.70 NPC1 (0.51) POLBHPGDNPSR1TDP1CASP6
SCHEMBL15338086 0.70 ALDH1A1 (0.48) POLBHPGDNPSR1TDP1CASP6

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-1904583-B1 PIGMENT DISPERSIONS WITH POLYMERIC DISPERSANTS HAVING PENDING CHROMOPHORE GROUPS. AGFA GRAPHICS NV (BE) 2012-03-21 EP disclosed