SCHEMBL19695945

SCHEMBL19695945

COc1cc(C2CC2C(=O)Nc2ccccc2C(=O)O)ccc1O

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LTB4R Q15722 1/20 0.56
▸ CHEK1 O14757 1/20 0.46
▸ PIM1 P11309 1/20 0.46
▸ MAPK8 P45983 1/20 0.46
▸ CLK4 Q9HAZ1 1/20 0.46
▸ KDM4E B2RXH2 4/20 0.46
▸ RECQL P46063 2/20 0.46
▸ APAF1 O14727 1/20 0.46
▸ CASP6 P55212 1/20 0.46
▸ CACNA1B Q00975 1/20 0.46
▸ APBA1 Q02410 1/20 0.46
▸ MCL1 Q07820 1/20 0.46
▸ CASP8 Q14790 1/20 0.46
▸ DEGS1 O15121 1/20 0.44
▸ APP P05067 1/20 0.44
▸ KMT2A Q03164 5/20 0.44
▸ MEN1 O00255 4/20 0.44
▸ ALDH1A1 P00352 3/20 0.44
▸ NPC1 O15118 2/20 0.44
▸ RAB9A P51151 2/20 0.44

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
SCHEMBL2950480 0.91 LTB4R (0.61) LTB4RCHEK1PIM1MAPK8CLK4
SCHEMBL13002056 0.87 LTB4R (0.55) LTB4RCHEK1PIM1MAPK8CLK4
SCHEMBL15396460 0.84 LTB4R (0.53) LTB4RCHEK1PIM1MAPK8CLK4
SCHEMBL9607122 0.82 LTB4R (0.52) LTB4RCHEK1PIM1MAPK8CLK4
SCHEMBL19695909 0.82 LTB4R (0.52) LTB4RCHEK1PIM1MAPK8CLK4
SCHEMBL19695907 0.82 LTB4R (0.52) LTB4RCHEK1PIM1MAPK8CLK4
SCHEMBL9607118 0.82 LTB4R (0.52) LTB4RCHEK1PIM1MAPK8CLK4
SCHEMBL15396459 0.81 LTB4R (0.47) LTB4RDEGS1ALDH1A1NPC1HTT
SCHEMBL2947337 0.80 LTB4R (0.48) LTB4RCHEK1PIM1MAPK8CLK4
SCHEMBL9607119 0.80 LTB4R (0.48) LTB4RCHEK1PIM1MAPK8CLK4

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
US-9839640-B2 Methods of treating eye diseases associated with inflammation and vascular proliferation OCCURX PTY LTD (AU) 2017-12-12 — — US disclosed
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