SCHEMBL24570906

SCHEMBL24570906

O=C1CCc2cc(C#Cc3ccccc3F)ccc21

nearest known ligand 0.68

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 17/20 0.68
ACACB O00763 1/20 0.44
HSD17B1 P14061 1/20 0.43
CASP1 P29466 1/20 0.41
CASP7 P55210 1/20 0.41
HSD17B10 Q99714 1/20 0.41

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
SCHEMBL30584430 1.00 GRM5 (0.68) GRM5ACACBHSD17B1CASP1CASP7
SCHEMBL10190633 0.92 GRM5 (0.70) GRM5HSD17B1
SCHEMBL10190652 0.89 GRM5 (0.61) GRM5ACACBHSD17B1CASP1CASP7
SCHEMBL10190651 0.82 GRM5 (0.67) GRM5ACACBHSD17B1CASP1CASP7
SCHEMBL10190650 0.82 GRM5 (1.00) GRM5ACACBCASP1CASP7HSD17B10
SCHEMBL504636 0.81 GRM5 (1.00) GRM5
SCHEMBL29739073 0.79 GRM5 (0.72) GRM5ACACBCASP1CASP7HSD17B10
SCHEMBL24570503 0.79 GRM5 (0.72) GRM5ACACBCASP1CASP7HSD17B10
SCHEMBL10190641 0.77 GRM5 (0.66) GRM5HSD17B1
SCHEMBL10190640 0.75 GRM5 (0.70) GRM5HSD17B1

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-116685313-A Indanyl-containing carboxylic acid compounds for the treatment of neurodegenerative diseases 细胞基因公司 2023-09-01 CN disclosed
WO-2022140555-A1 CARBOXYLIC ACID CONTAINING INDANYL COMPOUNDS FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES CELGENE CORPORATION (US) 2022-06-30 WO disclosed