SCHEMBL11136274

SCHEMBL11136274

COc1ccc(OC(=O)c2ccc(C)c(N)c2)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.54
TDP1 Q9NUW8 1/20 0.54
PRSS1 P07477 1/20 0.52
ACR P10323 1/20 0.52
CYP2C9 P11712 3/20 0.51
CYP1A2 P05177 2/20 0.51
CYP2C19 P33261 2/20 0.51
SMN1; SMN2 Q16637 2/20 0.51
LMNA P02545 1/20 0.51
KMT2A Q03164 6/20 0.51
KDM4E B2RXH2 2/20 0.51
MEN1 O00255 1/20 0.51
NPC1 O15118 1/20 0.51
CYP3A4 P08684 1/20 0.51
GFER P55789 1/20 0.49
CA1 P00915 2/20 0.47
CA2 P00918 2/20 0.47
PARP1 P09874 1/20 0.47
PARP10 Q53GL7 1/20 0.47
PARP2 Q9UGN5 1/20 0.47

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
SCHEMBL11143238 0.89 MAPT (0.55) MAPTTDP1PRSS1ACRLMNA
SCHEMBL11315797 0.89 MAPT (0.56) MAPTTDP1PRSS1ACRCYP2C9
SCHEMBL11581069 0.86 MAPT (0.53) MAPTTDP1PRSS1ACRSMN1; SMN2
SCHEMBL11136239 0.86 HTT (0.54) MAPTTDP1PRSS1ACRCYP2C9
SCHEMBL11140597 0.86 MAPT (0.56) MAPTTDP1PRSS1ACRSMN1; SMN2
SCHEMBL11142542 0.84 ALDH1A1 (0.63) MAPTPRSS1ACRCYP2C9CYP1A2
SCHEMBL11182852 0.84 PRSS1 (0.58) MAPTTDP1PRSS1ACRCYP1A2
SCHEMBL11584793 0.84 MAPT (0.57) MAPTTDP1CYP2C9CYP1A2CYP2C19
SCHEMBL11581046 0.84 MAPT (0.57) MAPTTDP1PRSS1ACRSMN1; SMN2
SCHEMBL11582919 0.83 MAPT (0.56) MAPTTDP1PRSS1ACRCYP2C9

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4392999-A COLORFAST BROWN, RED AND ORANGE CIBA-GEIGY CORPORATION (US) 1983-07-12 US disclosed
US-4263205-A FOR COLORING POLYMERS, LACQUERS CIBA-GEIGY CORPORATION (US) 1981-04-21 US disclosed
US-4229344-A Monazo pigments containing hydroxynaphthoylaminobenzimidazalone radical CIBA-GEIGY CORPORATION (US) 1980-10-21 US disclosed
US-4070353-A FOR PLASTICS AND PRINTING INKS, YELLOW TO ORANGE SHADES CIBA-GEIGY CORPORATION (US) 1978-01-24 US disclosed