SCHEMBL18272061

SCHEMBL18272061

CC(C)(C)C(=O)Oc1c(Br)cccc1Br

nearest known ligand 0.47

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ ELANE P08246 16/20 0.47
▸ PARP1 P09874 1/20 0.41
▸ PARP2 Q9UGN5 1/20 0.41
▸ POLB P06746 1/20 0.37

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
SCHEMBL28869670 0.78 ELANE (0.62) ELANE
SCHEMBL18263215 0.77 ELANE (0.47) ELANE
SCHEMBL9646427 0.77 KDM4E (0.48) ELANEPOLB
SCHEMBL28337676 0.76 HSD17B10 (0.35) POLB
SCHEMBL24926410 0.74 ELANE (0.53) ELANE
SCHEMBL11494190 0.73 ELANE (0.48) ELANEPOLB
SCHEMBL20306504 0.72 ELANE (0.54) ELANE
SCHEMBL6024449 0.72 CYP1A2 (0.53) ELANE
SCHEMBL17938475 0.72 ELANE (0.54) ELANE
SCHEMBL16300499 0.72 ELANE (0.47) ELANE

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-107108416-B Preparation method of 1, 2-dicyclopropylethylphenol and optical isomer thereof 四川海思科制药有限公司 2019-12-20 — — CN disclosed
WO-2016188490-A1 METHOD FOR PREPARING 1,2-DICYCLOPROPYLETHYLPHENOL AND OPTICAL ISOMER THEREOF 四川海思科制药有限公司 2016-12-01 — — WO disclosed
Send feedback