SCHEMBL10457604

SCHEMBL10457604

CC/C=C\CC(C(=O)O)C(=O)O

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GRIK1 P39086 2/20 0.55
▸ GRIK2 Q13002 2/20 0.55
▸ ALDH1A1 P00352 6/20 0.43
▸ MAPT P10636 4/20 0.43
▸ CYP19A1 P11511 4/20 0.43
▸ PPARG P37231 3/20 0.43
▸ OXER1 Q8TDS5 3/20 0.43
▸ RXRA P19793 2/20 0.43
▸ FFAR1 O14842 2/20 0.43
▸ FPR2 P25090 1/20 0.43
▸ F7 P08709 3/20 0.40
▸ F3 P13726 3/20 0.40
▸ PPARA Q07869 3/20 0.40
▸ PTGS1 P23219 3/20 0.40
▸ KMT2A Q03164 2/20 0.40
▸ PPARD Q03181 2/20 0.40
▸ ADORA3 P0DMS8 1/20 0.40
▸ TDP1 Q9NUW8 2/20 0.38
▸ FNTA P49354 1/20 0.38
▸ FNTB P49356 1/20 0.38

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
SCHEMBL4891724 1.00 GRIK1 (0.55) GRIK1GRIK2ALDH1A1MAPTCYP19A1
SCHEMBL4891721 1.00 GRIK1 (0.55) GRIK1GRIK2ALDH1A1MAPTCYP19A1
SCHEMBL3910423 0.85 FNTA (0.39) GRIK1GRIK2ALDH1A1TDP1FNTA
SCHEMBL3910421 0.85 FNTA (0.39) GRIK1GRIK2ALDH1A1TDP1FNTA
SCHEMBL28441194 0.83 GRIK1 (0.50) GRIK1GRIK2ALDH1A1MAPTCYP19A1
SCHEMBL9577751 0.82 GRIK1 (0.50) GRIK1GRIK2ALDH1A1MAPTCYP19A1
SCHEMBL6908844 0.82 GRIK1 (0.50) GRIK1GRIK2ALDH1A1MAPTCYP19A1
SCHEMBL16744146 0.82 GRIK1 (0.50) GRIK1GRIK2ALDH1A1MAPTCYP19A1
SCHEMBL9577748 0.82 GRIK1 (0.50) GRIK1GRIK2ALDH1A1MAPTCYP19A1
SCHEMBL10688481 0.82 GRIK1 (0.50) GRIK1GRIK2ALDH1A1MAPTCYP19A1

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
CN-115362246-A Cleaning agent composition and method for producing processed semiconductor substrate 日产化学株式会社 2022-11-18 — — CN disclosed
US-4923708-A ARYL, ALKYL OR ALKENYL DICARBOXYLIC ACID, CONFECTIONERY, COATINGS NABISCO BRANDS, INC. (US) 1990-05-08 — — US disclosed
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