SCHEMBL9149337

SCHEMBL9149337

CCOC(=O)c1ccc(OC(=O)Nc2ccc(C(=O)O)c(O)c2)cc1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 5/20 0.63
▸ HSD17B10 Q99714 3/20 0.63
▸ HPGD P15428 3/20 0.63
▸ CYP2D6 P10635 2/20 0.63
▸ MAPK1 P28482 2/20 0.63
▸ CYP1A2 P05177 2/20 0.63
▸ CYP2C9 P11712 2/20 0.63
▸ ALOX15 P16050 2/20 0.63
▸ CYP2C19 P33261 2/20 0.63
▸ CASP3 P42574 1/20 0.63
▸ SENP8 Q96LD8 1/20 0.63
▸ SENP7 Q9BQF6 1/20 0.63
▸ SENP6 Q9GZR1 1/20 0.63
▸ MAPT P10636 5/20 0.54
▸ KMT2A Q03164 5/20 0.54
▸ MEN1 O00255 4/20 0.54
▸ ALDH1A1 P00352 3/20 0.54
▸ THRB P10828 1/20 0.54
▸ KDM4E B2RXH2 4/20 0.52
▸ POLB P06746 1/20 0.52

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
SCHEMBL9149532 0.85 RAB9A (0.63) RAB9AHSD17B10HPGDCYP2D6MAPK1
SCHEMBL9149803 0.84 ALDH1A1 (0.58) RAB9AHSD17B10HPGDCYP2D6MAPK1
SCHEMBL8600796 0.84 ALDH1A1 (0.60) RAB9AHSD17B10HPGDCYP2D6MAPK1
SCHEMBL8602686 0.82 RAB9A (0.70) RAB9AHSD17B10HPGDCYP2D6MAPK1
SCHEMBL8654945 0.81 KDM4E (0.60) RAB9AHSD17B10HPGDCYP2D6MAPK1
SCHEMBL9150841 0.81 MAPT (0.54) RAB9AHSD17B10HPGDCYP2D6MAPK1
SCHEMBL9150983 0.81 FAAH (0.62) RAB9AHSD17B10HPGDCYP2D6MAPK1
SCHEMBL9150847 0.81 MAPT (0.64) RAB9AHSD17B10HPGDCYP2D6MAPK1
SCHEMBL7746891 0.80 MAPT (0.80) RAB9AHPGDMAPTKMT2AMEN1
SCHEMBL8603028 0.80 MAPT (0.78) RAB9AHSD17B10HPGDCYP2D6MAPK1

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-5476957-A Dye for heat sensitive recording MITSUI TOATSU CHEMICALS, INC. (JP) 1995-12-19 — — US disclosed
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