SCHEMBL11263149

SCHEMBL11263149

Cc1ccc(/C=C/c2cc(=O)n3cc(C(=O)O)ccc3n2)c(C)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALPG P10696 1/20 0.44
▸ AKR1B1 P15121 1/20 0.41
▸ CYP1A1 P04798 1/20 0.37
▸ CYP1B1 Q16678 1/20 0.37
▸ KDM4E B2RXH2 3/20 0.37
▸ MEN1 O00255 3/20 0.37
▸ MAPT P10636 3/20 0.37
▸ KMT2A Q03164 3/20 0.37
▸ TDP1 Q9NUW8 2/20 0.37
▸ POLB P06746 2/20 0.37
▸ LMNA P02545 1/20 0.37
▸ HSP90AA1 P07900 1/20 0.37
▸ ALOX12 P18054 1/20 0.37
▸ HTT P42858 1/20 0.37
▸ SMN1; SMN2 Q16637 1/20 0.37
▸ GRIN1 Q05586 1/20 0.36
▸ GRIN2A Q12879 1/20 0.36
▸ HPGD P15428 2/20 0.36
▸ ALDH1A1 P00352 1/20 0.36
▸ GAA P10253 1/20 0.36

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
SCHEMBL11263153 1.00 ALPG (0.44) ALPGAKR1B1CYP1A1CYP1B1KDM4E
SCHEMBL11245712 0.91 ALPG (0.42) ALPGAKR1B1KDM4EMEN1MAPT
SCHEMBL11245711 0.91 ALPG (0.42) ALPGAKR1B1KDM4EMEN1MAPT
SCHEMBL11250680 0.88 ALPG (0.42) ALPGAKR1B1KDM4EMAPTKMT2A
SCHEMBL11250685 0.88 ALPG (0.42) ALPGAKR1B1KDM4EMAPTKMT2A
SCHEMBL11249842 0.85 KDM4E (0.41) ALPGAKR1B1KDM4EMEN1MAPT
SCHEMBL11249851 0.85 KDM4E (0.41) ALPGAKR1B1KDM4EMEN1MAPT
SCHEMBL11261768 0.82 ALPG (0.49) ALPGAKR1B1CYP1A1CYP1B1KDM4E
SCHEMBL11257713 0.82 PTGS1 (0.42) ALPGAKR1B1KDM4EMAPTLMNA
SCHEMBL11261760 0.82 ALPG (0.49) ALPGAKR1B1CYP1A1CYP1B1KDM4E

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 2 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 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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