SCHEMBL18263215

SCHEMBL18263215

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

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ELANE P08246 1/20 0.47
▸ NPC1 O15118 2/20 0.41
▸ RAB9A P51151 2/20 0.41
▸ MEN1 O00255 1/20 0.41
▸ HTT P42858 1/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ KDM1A O60341 1/20 0.35
▸ CA2 P00918 2/20 0.35
▸ UCHL1 P09936 1/20 0.34
▸ MTNR1A P48039 1/20 0.34
▸ MTNR1B P49286 1/20 0.34
▸ CTSS P25774 2/20 0.33
▸ CTSK P43235 2/20 0.33
▸ RECQL P46063 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ HSD17B10 Q99714 1/20 0.33
▸ BCHE P06276 1/20 0.33
▸ CTSB P07858 1/20 0.32
▸ CA12 O43570 1/20 0.32
▸ CA1 P00915 1/20 0.32

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
SCHEMBL23258869 0.86 ELANE (0.42) ELANENPC1RAB9AMEN1HTT
SCHEMBL23258470 0.85 ELANE (0.39) ELANENPC1RAB9AMEN1HTT
SCHEMBL23259156 0.82 ELANE (0.40) ELANENPC1RAB9AMEN1HTT
SCHEMBL28337676 0.82 HSD17B10 (0.35) MEN1KMT2ACA2HSD17B10CA1
SCHEMBL21503790 0.80 ELANE (0.46) ELANENPC1RAB9AMEN1HTT
SCHEMBL2761277 0.79 ELANE (0.49) ELANEMEN1KMT2AKDM1ASMN1; SMN2
SCHEMBL2221010 0.79 ELANE (0.49) ELANEKMT2AKDM1ACA2HSD17B10
SCHEMBL23258801 0.79 SCN5A (0.40) ELANECA2CA1
SCHEMBL13244538 0.78 ELANE (0.47) ELANEKDM1ACA2
SCHEMBL27259478 0.78 ELANE (0.47) ELANENPC1RAB9AKDM1ACA2

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 4 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
CN-107108416-A A kind of preparation method of 1,2 Bicyclopropyl ethyl -phenol and its optical isomer 四川海思科制药有限公司 2017-08-29 — — 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
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
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