SCHEMBL11530682

SCHEMBL11530682

CC1=CC(C(=O)O)C(C(=O)O)CC1C

nearest known ligand 0.42

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.42
LMNA P02545 1/20 0.42
POLB P06746 1/20 0.42
FFAR1 O14842 4/20 0.36
GRM2 Q14416 2/20 0.32
GABRR1 P24046 1/20 0.32
GRM3 Q14832 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
SCHEMBL27846307 0.69 ALDH1A1 (0.60) ALDH1A1LMNAPOLBFFAR1GRM2
SCHEMBL27690040 0.69 ALDH1A1 (0.34) ALDH1A1LMNAPOLB
SCHEMBL21616456 0.67 ALDH1A1 (0.31) ALDH1A1LMNAPOLB
SCHEMBL9711305 0.67 GABRR1 (0.33) ALDH1A1LMNAPOLBGABRR1
SCHEMBL10708947 0.67 POLB (0.43) ALDH1A1LMNAPOLB
SCHEMBL284782 0.65 GABRR1 (0.36) ALDH1A1LMNAPOLBFFAR1GRM2
SCHEMBL9812712 0.65 GRM2 (0.33) ALDH1A1LMNAPOLBGRM2GRM3
SCHEMBL28207403 0.64 POLB (0.39) ALDH1A1LMNAPOLBGABRR1
SCHEMBL27825601 0.64 GABRR1 (0.34) ALDH1A1LMNAPOLBFFAR1GRM2
SCHEMBL9249637 0.63

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-4140606-A Process for preparing a polymerizable (meth) acrylate oligomer SHOWA DENKO K.K. (JP) 1979-02-20 US disclosed
US-4010289-A METHOD OF MANUFACTURING SYNTHETIC RESIN FILM HAVING HIGH WRITABILITY AND PRINTABILITY SHOWA DENKO KABUSHIKI KAISHA (JA) 1977-03-01 US disclosed