SCHEMBL27893504

SCHEMBL27893504

Cc1cc([SH]2CCCCC2)cc(C)c1O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 1/20 0.44
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
ESR1 P03372 1/20 0.34
ESR2 Q92731 1/20 0.34
CYP2C9 P11712 2/20 0.32
ALDH1A1 P00352 2/20 0.32
PTGS1 P23219 3/20 0.31
PTGS2 P35354 3/20 0.31
ALOX5 P09917 2/20 0.31
GAA P10253 2/20 0.31
CYP1A2 P05177 1/20 0.31
CYP3A4 P08684 1/20 0.31
CYP2D6 P10635 1/20 0.31
CYP2B6 P20813 1/20 0.31
MEN1 O00255 1/20 0.31
G6PD P11413 1/20 0.31
KMT2A Q03164 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
TTR P02766 1/20 0.31

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
SCHEMBL29039139 0.98 CA1 (0.44) ACHECA1CA2ESR1ESR2
SCHEMBL28150786 0.78 ESR1 (0.44) ESR1ESR2CYP2C9ALDH1A1CYP1A2
SCHEMBL26156858 0.75 POLB (0.30)
SCHEMBL25658016 0.75 ALDH1A1 (0.33) ACHEALDH1A1MEN1KMT2A
SCHEMBL25819629 0.72 ALDH1A1 (0.33) ACHEALDH1A1
SCHEMBL30274976 0.71 CA1 (0.35) ACHECA1CA2ESR1ESR2
SCHEMBL27353180 0.71 CA1 (0.55) ACHECA1CA2ESR1ESR2
SCHEMBL14479116 0.67 CA1 (0.35) ACHECA1CA2
SCHEMBL25477065 0.65 ACHE (0.40) ACHECA1CA2ALDH1A1
SCHEMBL27524308 0.65 ALDH1A1 (0.40) ACHECA1CA2ESR1ESR2

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-107850698-A Laminates, LCD MODULE, the manufacture method of back light unit and laminates 惠和株式会社 2018-03-27 CN disclosed
CN-102929030-A Optical sheet and touch panel KEIWA INC 2013-02-13 CN disclosed