SCHEMBL17962437

SCHEMBL17962437

CC(C)c1cccc(Br)c1N(C(=O)O)[C@H](C)c1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.40
LMNA P02545 1/20 0.40
ALOX5 P09917 1/20 0.40
ALDH1A1 P00352 2/20 0.37
TRPM8 Q7Z2W7 1/20 0.37
MTOR P42345 1/20 0.36
HPGD P15428 1/20 0.35
MEN1 O00255 1/20 0.35
MAPT P10636 1/20 0.35
CYP2C9 P11712 1/20 0.35

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
SCHEMBL18263186 0.91 ALOX5 (0.46) KMT2ALMNAALOX5ALDH1A1TRPM8
SCHEMBL18263185 0.91 ALOX5 (0.46) KMT2ALMNAALOX5ALDH1A1TRPM8
SCHEMBL28364875 0.79 LMNA (0.37) KMT2ALMNAALOX5TRPM8
SCHEMBL28167401 0.79 LMNA (0.37) KMT2ALMNAALOX5TRPM8
SCHEMBL28171272 0.79 LMNA (0.37) KMT2ALMNAALOX5TRPM8
SCHEMBL28361461 0.79 LMNA (0.37) KMT2ALMNAALOX5TRPM8
SCHEMBL28167397 0.79 LMNA (0.37) KMT2ALMNAALOX5TRPM8
SCHEMBL28392659 0.76 ALOX15 (0.37) KMT2ALMNAALOX5ALDH1A1TRPM8
SCHEMBL28338187 0.73 TRPM8 (0.39) KMT2ALMNAALOX5TRPM8MTOR
SCHEMBL18263192 0.69 TRPM8 (0.38) KMT2ALMNAALOX5ALDH1A1TRPM8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107108483-B Preparation method and intermediate of 2- [ 1-cycloalkylethyl ] phenol 四川海思科制药有限公司 2020-05-22 CN disclosed
CN-107074675-B Preparation method of chiral 2- [ 1-cyclopropylethyl ] -6-isopropyl-phenol 四川海思科制药有限公司 2019-12-20 CN disclosed
CN-107108483-A A kind of Preparation Method And Their Intermediate of 2 [1 cycloalkylethyl] phenol 四川海思科制药有限公司 2017-08-29 CN disclosed
CN-107074675-A Preparation method of chiral 2- [ 1-cyclopropylethyl ] -6-isopropyl-phenol 四川海思科制药有限公司 2017-08-18 CN disclosed
WO-2016119757-A1 METHOD FOR PREPARING 2-[1-CYCLOALKYLETHYL] PHENOL AND INTERMEDIATE THEREOF 四川海思科制药有限公司 2016-08-04 WO disclosed
WO-2016119758-A1 METHOD FOR PREPARING CHIRAL 2-[1-CYCLOPROPYLETHYL]-6-ISOPROPYL-PHENOL 四川海思科制药有限公司 2016-08-04 WO disclosed