SCHEMBL436786

SCHEMBL436786

Clc1ccc[c]c1C1CCCCC1

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 2/20 0.33
GLA P06280 1/20 0.33
HTT P42858 1/20 0.33
GRM2 Q14416 1/20 0.33
NPC1 O15118 2/20 0.33
RAB9A P51151 2/20 0.33
CEL P19835 2/20 0.33
ALDH1A1 P00352 2/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
HPGD P15428 1/20 0.32
TSHR P16473 1/20 0.32
CYP11B2 P19099 1/20 0.32
FFAR2 O15552 1/20 0.32
HSD11B1 P28845 1/20 0.31
CYP2D6 P10635 1/20 0.31
SLC6A2 P23975 1/20 0.31
SLC6A4 P31645 1/20 0.31
SLC6A3 Q01959 1/20 0.31
KCNH2 Q12809 1/20 0.31
L3MBTL1 Q9Y468 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
SCHEMBL19405506 0.98 GLA (0.34) NPSR1GLAHTTGRM2NPC1
SCHEMBL19405361 0.94 TP53 (0.32) NPSR1GLAHTTTP53RECQL
SCHEMBL458668 0.90 TP53 (0.33) NPC1RAB9AALDH1A1SMN1; SMN2TSHR
SCHEMBL9644212 0.78 PTGDR2 (0.36) CELCYP11B2
SCHEMBL529103 0.78 PTGDR2 (0.36) CELCYP11B2
SCHEMBL3773177 0.78 ESR1 (0.41) GRM2CYP2D6TP53RECQLMEN1
SCHEMBL2724600 0.77 GRM2 (0.33) GRM2SMN1; SMN2TSHRHSD11B1
SCHEMBL961820 0.77 HDAC4 (0.40) HTTNPC1RAB9AALDH1A1SMN1; SMN2
SCHEMBL1816231 0.77 SIGMAR1 (0.34) NPC1RAB9ACYP11B2LMNA
SCHEMBL3813711 0.77 PTPRC (0.32) CYP11B2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107004906-B Magnesium-containing electrolyte 富士胶片和光纯药株式会社 2020-04-21 CN disclosed
US-10367231-B2 Magnesium-containing electrolytic solution FUJIFILM WAKO PURE CHEMICAL CORPORATION (JP) 2019-07-30 US disclosed
EP-3226340-B1 MAGNESIUM-CONTAINING ELECTROLYTIC SOLUTION FUJIFILM WAKO PURE CHEMICAL CORP (JP) 2018-11-07 EP disclosed
US-20170331154-A1 MAGNESIUM-CONTAINING ELECTROLYTIC SOLUTION WAKO PURE CHEMICAL INDUSTRIES, LTD. (JP) 2017-11-16 US disclosed
EP-3226340-A1 MAGNESIUM-CONTAINING ELECTROLYTIC SOLUTION Wako Pure Chemical Industries, Ltd. (JP) 2017-10-04 EP disclosed
EP-2595984-A1 MICROBICIDES Syngenta Participations AG (CH) 2013-05-29 EP disclosed
EP-2595985-A1 ISOXAZOLE, ISOTHIAZOLE, FURANE AND THIOPHENE COMPOUNDS AS MICROBICIDES Syngenta Participations AG (CH) 2013-05-29 EP disclosed
WO-2012010568-A1 MICROBICIDES SYNGENTA PARTICIPATIONS AG (CH) 2012-01-26 WO disclosed
WO-2012010567-A1 ISOXAZOLE, ISOTHIAZOLE, FURANE AND THIOPHENE COMPOUNDS AS MICROBICIDES SYNGENTA PARTICIPATIONS AG (CH) 2012-01-26 WO disclosed
US-4374136-A Pyrimidine derivatives MAY & BAKER LIMITED (GB) 1983-02-15 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-10367231-B2 Magnesium-containing electrolytic solution CA1, CA3, CA2 NPSR1 2613/4885GLA 158/4885HTT 4259/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.