SCHEMBL28060106

SCHEMBL28060106

CC(C)c1cccc([C@@H](C)C(=O)O)c1OCc1ccccc1

nearest known ligand 0.60

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GLRA1 P23415 2/20 0.60
ALDH1A1 P00352 1/20 0.44
LMNA P02545 2/20 0.43
HPGD P15428 1/20 0.43
FFAR1 O14842 3/20 0.43
MAOB P27338 2/20 0.41
PTPN1 P18031 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
PPARG P37231 1/20 0.40
PPARA Q07869 1/20 0.40

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
SCHEMBL28060114 1.00 GLRA1 (0.60) GLRA1ALDH1A1LMNAHPGDFFAR1
SCHEMBL28060142 1.00 GLRA1 (0.60) GLRA1ALDH1A1LMNAHPGDFFAR1
SCHEMBL28060109 0.89 GLRA1 (0.58) GLRA1ALDH1A1LMNAHPGDFFAR1
SCHEMBL28060105 0.89 GLRA1 (0.65) GLRA1ALDH1A1LMNAHPGDFFAR1
SCHEMBL28078446 0.87 GLRA1 (0.60) GLRA1ALDH1A1LMNAHPGDMAOB
SCHEMBL27794250 0.85 PTGER1 (0.48) GLRA1ALDH1A1LMNAHPGDFFAR1
SCHEMBL28739338 0.84 GLRA1 (0.47) GLRA1ALDH1A1LMNAHPGDFFAR1
SCHEMBL26908057 0.83 GLRA1 (0.57) GLRA1ALDH1A1LMNAHPGDFFAR1
SCHEMBL128058 0.82 GLRA1 (0.57) GLRA1ALDH1A1LMNAHPGDFFAR1
SCHEMBL26908096 0.81 GLRA1 (0.56) GLRA1ALDH1A1LMNAHPGDFFAR1

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-105384608-B A kind of cumene amphyl and preparation method thereof 四川海思科制药有限公司 2019-08-16 CN disclosed
CN-105384608-A Isopropyl-phenol derivative and preparation method therefor SICHUAN HAISCO PHARMACEUTICAL CO LTD 2016-03-09 CN disclosed