SCHEMBL10937622

SCHEMBL10937622

COC(=O)c1c[nH]c(C(=O)c2ccccc2)c1-c1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NR4A2 P43354 3/20 0.49
▸ AXL P30530 2/20 0.47
▸ CREBBP Q92793 1/20 0.47
▸ TSHR P16473 1/20 0.46
▸ LMNA P02545 2/20 0.44
▸ HTT P42858 1/20 0.43
▸ SLC6A3 Q01959 1/20 0.43
▸ ALDH1A1 P00352 5/20 0.42
▸ SMN1; SMN2 Q16637 2/20 0.41
▸ RAB9A P51151 1/20 0.41
▸ MAP2K1 Q02750 1/20 0.40
▸ CYP3A4 P08684 1/20 0.40
▸ MAPT P10636 1/20 0.40
▸ CYP2C9 P11712 1/20 0.40
▸ CYP2C19 P33261 1/20 0.40
▸ NPSR1 Q6W5P4 1/20 0.40
▸ GABRA1 P14867 1/20 0.40
▸ GABRG2 P18507 1/20 0.40
▸ GABRB3 P28472 1/20 0.40
▸ GABRA3 P34903 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
SCHEMBL10941063 0.83 ALDH1A1 (0.47) ALDH1A1MAPTNPSR1
SCHEMBL30880013 0.81 NR4A2 (0.40) NR4A2AXLCREBBPTSHRLMNA
SCHEMBL1156222 0.79 NR4A2 (0.57) NR4A2AXLCREBBPTSHRLMNA
SCHEMBL1156693 0.78 NR4A2 (0.52) NR4A2AXLCREBBPTSHRLMNA
SCHEMBL19064199 0.74 SLC6A4 (0.51) NR4A2CREBBPTSHRLMNAHTT
SCHEMBL10939265 0.73 TSHR (0.57) NR4A2CREBBPTSHRLMNAHTT
SCHEMBL10942950 0.72 SMN1; SMN2 (0.57) NR4A2AXLTSHRLMNASLC6A3
SCHEMBL26553256 0.72 LMNA (0.48) NR4A2AXLCREBBPTSHRLMNA
SCHEMBL28000 0.71 TSHR (0.63) TSHRLMNAHTTSLC6A3ALDH1A1
SCHEMBL29363206 0.71 TSHR (0.63) TSHRLMNAHTTSLC6A3ALDH1A1

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
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