SCHEMBL10752287

SCHEMBL10752287

CCC(C(=O)O)C(=O)N(CCC(=O)OC)Cc1ccc(NC(=O)OCc2ccccc2)cc1

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 2/20 0.44
▸ LMNA P02545 2/20 0.44
▸ KMT2A Q03164 2/20 0.44
▸ POLB P06746 1/20 0.44
▸ TP53 P04637 1/20 0.42
▸ MAPT P10636 1/20 0.42
▸ KDM1A O60341 2/20 0.41
▸ MAOA P21397 2/20 0.41
▸ MAOB P27338 2/20 0.41
▸ CCKBR P32239 1/20 0.41
▸ NPC1 O15118 1/20 0.41
▸ RAB9A P51151 1/20 0.41
▸ SMN1; SMN2 Q16637 1/20 0.41
▸ ROCK2 O75116 1/20 0.41
▸ RCOR1 Q9UKL0 1/20 0.41
▸ PTGDR2 Q9Y5Y4 3/20 0.40
▸ MGLL Q99685 1/20 0.40
▸ KAT2B Q92831 1/20 0.40
▸ TGM2 P21980 1/20 0.40

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
SCHEMBL10973108 0.85 POLB (0.48) POLBTP53MAPTKDM1AMAOA
SCHEMBL10752283 0.80 KMT2A (0.48) MEN1LMNAKMT2APOLBTP53
SCHEMBL10752292 0.79 HDAC6 (0.37) LMNA
SCHEMBL10757422 0.79 ITGB3 (0.37) MEN1LMNAKMT2AMAPT
SCHEMBL8319764 0.78 POLB (0.58) MEN1LMNAKMT2APOLBTP53
SCHEMBL10753221 0.75 ALDH1A1 (0.48) MEN1LMNAKMT2AMAPTSMN1; SMN2
SCHEMBL10749977 0.75 MC4R (0.44) LMNAKMT2AMAPTSMN1; SMN2
SCHEMBL9315961 0.73 POLB (0.61) MEN1KMT2APOLBTP53MAPT
SCHEMBL592715 0.72 POLB (0.66) MEN1KMT2APOLBTP53MAPT
SCHEMBL590420 0.70 POLB (0.62) MEN1KMT2APOLBTP53MAPT

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-4663319-A LIVER DISORDERS TANABE SEIYSKU CO., LTD. (JP) 1987-05-05 — — US disclosed
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