SCHEMBL10938005

SCHEMBL10938005

COC(=O)c1c[nH]c(C(=O)Cc2ccccc2)c1

nearest known ligand 0.80

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.80
RAB9A P51151 2/20 0.62
GAA P10253 2/20 0.62
KMT2A Q03164 3/20 0.59
MEN1 O00255 2/20 0.56
BAZ2B Q9UIF8 1/20 0.52
BAZ2A Q9UIF9 1/20 0.52
LMNA P02545 3/20 0.52
NPC1 O15118 1/20 0.49
TSHR P16473 1/20 0.46
HPGD P15428 1/20 0.46
IDO1 P14902 1/20 0.44
CA1 P00915 1/20 0.44
CA2 P00918 1/20 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
SCHEMBL1149553 0.89 ALDH1A1 (1.00) ALDH1A1RAB9AGAAKMT2AMEN1
SCHEMBL10939119 0.83 RAB9A (0.77) ALDH1A1RAB9AGAAKMT2AMEN1
SCHEMBL10936334 0.79 ALDH1A1 (0.57) ALDH1A1RAB9AGAAKMT2AMEN1
SCHEMBL1149220 0.78 ALDH1A1 (0.76) ALDH1A1RAB9AGAAKMT2AMEN1
SCHEMBL8284046 0.77 RAB9A (1.00) ALDH1A1RAB9AGAAKMT2AMEN1
SCHEMBL1428773 0.77 RAB9A (0.67) ALDH1A1RAB9AGAANPC1TSHR
SCHEMBL70354 0.76 BAZ2B (0.71) ALDH1A1GAABAZ2BBAZ2ALMNA
SCHEMBL10940550 0.76 ALDH1A1 (0.61) ALDH1A1RAB9AGAAKMT2AMEN1
SCHEMBL1006532 0.75 ALDH1A1 (0.76) ALDH1A1RAB9AGAAKMT2AMEN1
SCHEMBL3977780 0.75 ALDH1A1 (0.67) ALDH1A1RAB9AGAAKMT2AMEN1

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-4511575-A Antidiabetic pyrrolecarboxylic acids PFIZER INC. (US) 1985-04-16 US disclosed
US-4511576-A Antidiabetic pyrrolecarboxylic acids PFIZER INC. (US) 1985-04-16 US disclosed
US-4351843-A LOWERING BLOOD GLUCOSE PFIZER INC. (US) 1982-09-28 US disclosed
US-4282242-A HYPOGLYCEMIC AGENTS PFIZER INC. (US) 1981-08-04 US disclosed