SCHEMBL28060105

SCHEMBL28060105

CC(C)c1cccc(C(C)C(=O)Cl)c1OCc1ccccc1

nearest known ligand 0.65

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GLRA1 P23415 2/20 0.65
LMNA P02545 2/20 0.42
HPGD P15428 1/20 0.42
ALDH1A1 P00352 1/20 0.41
FFAR1 O14842 3/20 0.41
THRA P10827 1/20 0.41
THRB P10828 1/20 0.41
KDM4E B2RXH2 1/20 0.41
MAOB P27338 2/20 0.40
PTPN1 P18031 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39

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
SCHEMBL28060106 0.89 GLRA1 (0.60) GLRA1LMNAHPGDALDH1A1FFAR1
SCHEMBL28060142 0.89 GLRA1 (0.60) GLRA1LMNAHPGDALDH1A1FFAR1
SCHEMBL28060114 0.89 GLRA1 (0.60) GLRA1LMNAHPGDALDH1A1FFAR1
SCHEMBL28060109 0.86 GLRA1 (0.58) GLRA1LMNAHPGDALDH1A1FFAR1
SCHEMBL28078446 0.85 GLRA1 (0.60) GLRA1LMNAHPGDALDH1A1MAOB
SCHEMBL26908057 0.81 GLRA1 (0.57) GLRA1LMNAHPGDALDH1A1FFAR1
SCHEMBL128058 0.80 GLRA1 (0.57) GLRA1LMNAHPGDALDH1A1FFAR1
SCHEMBL26908068 0.80 GLRA1 (0.56) GLRA1LMNAHPGDALDH1A1FFAR1
SCHEMBL16860746 0.79 GLRA1 (1.00) GLRA1LMNAHPGDALDH1A1THRA
SCHEMBL28060081 0.78 GLRA1 (0.55) GLRA1LMNAHPGDALDH1A1FFAR1

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