SCHEMBL11243598

SCHEMBL11243598

Cc1c(/C=C/c2cccc(Cl)c2)nc2ccc(C(=O)O)cn2c1=O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALPG P10696 1/20 0.43
▸ AKR1B1 P15121 1/20 0.43
▸ CYP1A2 P05177 3/20 0.42
▸ CYP2C9 P11712 1/20 0.42
▸ KDM4E B2RXH2 3/20 0.41
▸ ALDH1A1 P00352 3/20 0.41
▸ HPGD P15428 3/20 0.41
▸ MAOB P27338 3/20 0.41
▸ HSD17B10 Q99714 3/20 0.41
▸ ADORA2A P29274 2/20 0.41
▸ BLM P54132 2/20 0.41
▸ CYP2D6 P10635 1/20 0.41
▸ HIF1A Q16665 1/20 0.41
▸ GLA P06280 1/20 0.41
▸ ADORA2B P29275 1/20 0.41
▸ AHR P35869 1/20 0.41
▸ PMP22 Q01453 1/20 0.41
▸ SMN1; SMN2 Q16637 2/20 0.40
▸ CASP1 P29466 2/20 0.40
▸ LMNA P02545 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
SCHEMBL11243612 1.00 ALPG (0.43) ALPGAKR1B1CYP1A2CYP2C9KDM4E
SCHEMBL11255541 0.90 ALPG (0.44) ALPGAKR1B1KDM4EALDH1A1HPGD
SCHEMBL11255538 0.90 ALPG (0.44) ALPGAKR1B1KDM4EALDH1A1HPGD
SCHEMBL11245407 0.89 AKR1B1 (0.51) ALPGAKR1B1TTR
SCHEMBL11245411 0.89 AKR1B1 (0.51) ALPGAKR1B1TTR
SCHEMBL11254681 0.89 P2RX3 (0.46) ALPGAKR1B1KDM4EALDH1A1HPGD
SCHEMBL11254686 0.89 P2RX3 (0.46) ALPGAKR1B1KDM4EALDH1A1HPGD
SCHEMBL11255503 0.88 ALPG (0.43) ALPGAKR1B1CYP1A2KDM4EALDH1A1
SCHEMBL11255509 0.88 ALPG (0.43) ALPGAKR1B1CYP1A2KDM4EALDH1A1
SCHEMBL11249635 0.87 ALPG (0.43) ALPGAKR1B1CYP1A2KDM4EALDH1A1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4341780-A Substituted pyrido [1,2-a] pyrimidines useful as anti-allergic, anti-ulcer and anti-diabetic agents FARMITALIA CARLO ERBA S.P.A. (IT) 1982-07-27 — — US claimed
US-4341780-A Substituted pyrido [1,2-a] pyrimidines useful as anti-allergic, anti-ulcer and anti-diabetic agents FARMITALIA CARLO ERBA S.P.A. (IT) 1982-07-27 — — US disclosed
US-4310526-A Substituted 6,7-methylene pyrido[1,2-a]pyrimidines useful as anti-allergic and anti-ulcer agents FARMITALIA CARLO ERBA S.P.A. (IT) 1982-01-12 — — US disclosed
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