SCHEMBL10348490

SCHEMBL10348490

CC(=O)C1C(=O)CC(C(=O)O)CC1=O

nearest known ligand 0.54

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.38
POLB P06746 3/20 0.37
APLNR P35414 1/20 0.34
RECQL P46063 1/20 0.33
CYP2C19 P33261 1/20 0.32
GAA P10253 1/20 0.32
KMT2A Q03164 1/20 0.31
AKR1C3 P42330 1/20 0.31
AKR1C1 Q04828 1/20 0.31
ABAT P80404 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL20707223 1.00 MAPT (0.38) MAPTPOLBAPLNRRECQLCYP2C19
SCHEMBL125826 0.78 POLB (0.36) MAPTPOLBAPLNRAKR1C3AKR1C1
SCHEMBL13242149 0.77 MAPT (0.34) MAPTPOLBAPLNRCYP2C19GAA
SCHEMBL10595119 0.77 POLB (0.42) MAPTPOLBAPLNRRECQL
SCHEMBL180151 0.77 POLB (0.35) MAPTPOLBAPLNRAKR1C3AKR1C1
Calcium SCHEMBL29816288 0.77 POLB (0.35) MAPTPOLBAPLNRAKR1C3AKR1C1
SCHEMBL4264381 0.76 CRBN (0.39)
SCHEMBL9483336 0.76 AKR1C3 (0.37) MAPTPOLBCYP2C19GAAKMT2A
SCHEMBL1743259 0.75 TLR4 (0.32) MAPTPOLB
SCHEMBL9788268 0.74 HSD17B10 (0.50) MAPTPOLBGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0123001-B1 NEW CYCLOHEXANE DERIVATIVES HAVING PLANT-GROWTH REGULATING ACTIVITIES, AND USES OF THESE DERIVATIVES KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) 1990-04-25 EP claimed
US-4678496-A CROPS AND LAWNS KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) 1987-07-07 US claimed
EP-0123001-A1 New cyclohexane derivatives having plant-growth regulating activities, and uses of these derivatives KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) 1984-10-31 EP claimed
CN-1185202-C Process for preparation of acylated 1,3-dicarbonyl compounds SYNGENTA PARTICIPATIONS AG (CH) 2005-01-19 CN disclosed
CN-1368947-A Process for preparation of acylated 1,3-dicarbonyl compounds SYNGENTA PARTICIPATIONS AG (CH) 2002-09-11 CN disclosed
US-4866201-A CYCLIZATION ACETONYLSUCCINIC ACID ESTER; REACTING WITH ORGANIC ACID CHLORIDE; THEN REARRANGEMENT KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) 1989-09-12 US disclosed
US-4678496-A CROPS AND LAWNS KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) 1987-07-07 US disclosed
US-4560403-A Cyclohexane derivatives having plant-growth regulating activities, and uses of these derivatives KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) 1985-12-24 US disclosed
EP-0123001-A1 New cyclohexane derivatives having plant-growth regulating activities, and uses of these derivatives KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) 1984-10-31 EP disclosed