SCHEMBL10939265

SCHEMBL10939265

COC(=O)c1c[nH]cc1C(=O)c1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.57
ALDH1A1 P00352 6/20 0.54
SLC6A3 Q01959 2/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
KDM4E B2RXH2 6/20 0.49
POLB P06746 1/20 0.49
ATM Q13315 1/20 0.49
NR4A2 P43354 1/20 0.47
CREBBP Q92793 1/20 0.47
LMNA P02545 3/20 0.47
HSD17B10 Q99714 4/20 0.46
MAPT P10636 3/20 0.46
MAPK1 P28482 3/20 0.46
ALOX15 P16050 2/20 0.46
CFTR P13569 1/20 0.46
AKR1C3 P42330 1/20 0.46
HPGD P15428 2/20 0.45
CYP1A2 P05177 1/20 0.45
PGR P06401 1/20 0.45
CYP2D6 P10635 1/20 0.45

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
SCHEMBL10942950 0.90 SMN1; SMN2 (0.57) TSHRALDH1A1SLC6A3SMN1; SMN2KDM4E
SCHEMBL10940863 0.84 TDP1 (0.58) ALDH1A1SMN1; SMN2KDM4EPOLBNR4A2
SCHEMBL28000 0.83 TSHR (0.63) TSHRALDH1A1SLC6A3KDM4EPOLB
SCHEMBL27840685 0.83 TSHR (0.63) TSHRALDH1A1SLC6A3KDM4EPOLB
SCHEMBL29363206 0.83 TSHR (0.63) TSHRALDH1A1SLC6A3KDM4EPOLB
SCHEMBL10939874 0.83 SMN1; SMN2 (0.60) ALDH1A1SMN1; SMN2KDM4EPOLBNR4A2
Benzophenone SCHEMBL29531226 0.81 TSHR (0.61) TSHRALDH1A1SLC6A3KDM4EPOLB
Water SCHEMBL27735757 0.81 TSHR (0.61) TSHRALDH1A1SLC6A3KDM4EPOLB
SCHEMBL10938217 0.81 POLB (0.47) SLC6A3POLBNR4A2LMNAMAPT
SCHEMBL69740 0.80 NR4A2 (0.48) TSHRALDH1A1KDM4EPOLBATM

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