SCHEMBL10939397

SCHEMBL10939397

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

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 6/20 0.58
▸ MAPT P10636 2/20 0.55
▸ SRD5A2 P31213 1/20 0.52
▸ RAB9A P51151 2/20 0.51
▸ GAA P10253 2/20 0.51
▸ NPC1 O15118 1/20 0.49
▸ HSP90AA1 P07900 1/20 0.49
▸ PKM P14618 1/20 0.49
▸ SMN1; SMN2 Q16637 1/20 0.49
▸ NOTUM Q6P988 1/20 0.48
▸ DAO P14920 1/20 0.48
▸ TSHR P16473 1/20 0.48
▸ NAPRT Q6XQN6 1/20 0.48
▸ TDP1 Q9NUW8 2/20 0.47
▸ ATM Q13315 1/20 0.47
▸ L3MBTL1 Q9Y468 1/20 0.47
▸ MAPK7 Q13164 1/20 0.47
▸ CYP2C8 P10632 1/20 0.46
▸ CYP2C9 P11712 1/20 0.46
▸ KDM4E B2RXH2 1/20 0.46

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
SCHEMBL10938127 0.90 DHODH (0.51) ALDH1A1MAPTSRD5A2RAB9AGAA
SCHEMBL2419793 0.85 ALDH1A1 (0.68) ALDH1A1MAPTSRD5A2RAB9AGAA
SCHEMBL10944870 0.84 POLB (0.51) ALDH1A1SRD5A2RAB9AGAANPC1
SCHEMBL10938851 0.84 HTT (0.64) ALDH1A1MAPTSRD5A2RAB9AGAA
SCHEMBL10936789 0.84 SRD5A2 (0.58) ALDH1A1SRD5A2RAB9AGAANPC1
SCHEMBL10941754 0.83 ALOX15 (0.51) ALDH1A1MAPTRAB9AGAANPC1
SCHEMBL10942146 0.83 POLB (0.54) ALDH1A1MAPTRAB9AGAANPC1
SCHEMBL10938094 0.83 L3MBTL1 (0.50) ALDH1A1MAPTRAB9AGAANOTUM
SCHEMBL10936334 0.81 ALDH1A1 (0.57) ALDH1A1MAPTRAB9AGAANPC1
SCHEMBL10940033 0.80 ALDH1A1 (0.67) ALDH1A1RAB9AGAASMN1; SMN2NOTUM

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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