SCHEMBL4654285

SCHEMBL4654285

[CH2]CC(C1CCCCC1)C1CCCCC1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 2/20 0.55
SHBG P04278 1/20 0.42
TP53 P04637 3/20 0.41
LMNA P02545 3/20 0.41
CYP2D6 P10635 2/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
ALDH1A1 P00352 2/20 0.41
CYP1A2 P05177 1/20 0.41
TSHR P16473 1/20 0.41
MLNR O43193 1/20 0.41
ABCB11 O95342 1/20 0.41
EGFR P00533 1/20 0.41
FYN P06241 1/20 0.41
CHRM2 P08172 1/20 0.41
CHRM4 P08173 1/20 0.41
HTR1A P08908 1/20 0.41
CHRM5 P08912 1/20 0.41
ADRA2A P08913 1/20 0.41
ADORA3 P0DMS8 1/20 0.41

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
SCHEMBL4653067 0.97 EPHX1 (0.50) EPHX1SHBGTP53LMNACYP2D6
SCHEMBL4654403 0.84
SCHEMBL9949234 0.78 EPHX1 (0.50) EPHX1SHBGTP53LMNACYP2D6
SCHEMBL9213980 0.77 EPHX1 (0.42) EPHX1SHBGTP53LMNACYP2D6
SCHEMBL9821330 0.75 EPHX1 (0.60) EPHX1SHBGTP53LMNACYP2D6
SCHEMBL3263270 0.74 EPHX1 (0.40) EPHX1SHBGTP53LMNACYP2D6
SCHEMBL3417081 0.74 EPHX1 (0.46) EPHX1SHBGTP53LMNACYP2D6
SCHEMBL9202551 0.73 EPHX1 (0.38) EPHX1SHBGTP53LMNAALDH1A1
SCHEMBL1193486 0.72 SHBG (0.44) EPHX1SHBGTP53LMNAMAPT
SCHEMBL954759 0.72 SHBG (0.44) EPHX1SHBGTP53LMNAMAPT

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 27 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10328683-B2 Adhesive agent, adhesive material using the same, and method of use thereof HITACHI CHEMICAL COMPANY, LTD. (JP) 2019-06-25 US disclosed
US-10322572-B2 Adhesive agent, adhesive material using the same, and method of use thereof HITACHI CHEMICAL COMPANY, LTD. (JP) 2019-06-18 US disclosed
US-9446576-B2 Adhesive agent, adhesive material using the same, and method of use thereof HITACHI CHEMICAL COMPANY, LTD. (JP) 2016-09-20 US disclosed
CN-103391947-B Stabilization of polymers containing hydrolyzable functional groups 株式会社普利司通 2016-08-24 CN disclosed
US-20130020021-A1 ADHESIVE AGENT, ADHESIVE MATERIAL USING THE SAME, AND METHOD OF USE THEREOF HITACHI CHEMICAL COMPANY, LTD. 2013-01-24 US disclosed
US-20130008592-A1 ADHESIVE AGENT, ADHESIVE MATERIAL USING THE SAME, AND METHOD OF USE THEREOF HITACHI CHEMICAL COMPANY, LTD. 2013-01-10 US disclosed
US-20130008593-A1 ADHESIVE AGENT, ADHESIVE MATERIAL USING THE SAME, AND METHOD OF USE THEREOF HITACHI CHEMICAL COMPANY, LTD. 2013-01-10 US disclosed
EP-2479159-A1 PREPARATION METHOD FOR COMPOUND PROVIDED WITH DOUBLE BOND Sumitomo Chemical Co., Ltd (JP) 2012-07-25 EP disclosed
US-20120165587-A1 Method for Producing a Compound with a Double Bond SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-06-28 US disclosed
CN-102471176-A Non-polar and polar leaving groups BAYER SCHERING PHARMA AG 2012-05-23 CN disclosed
EP-0846108-A1 AMINO-SUBSTITUTED THIADIAZOLES, PYRIMIDINES, TRIAZINES OR TRIAZOLES USEFUL AS CTF RECEPTOR ANTAGONISTS NEUROCRINE BIOSCIENCES, INC. (US) 1998-06-10 EP disclosed
EP-0625507-B1 Urea derivatives and their use as acat inhibitors NISSHIN FLOUR MILLING CO (JP) 1997-07-23 EP disclosed
US-5621010-A ANTIHYPERCHOLESTEROLEMIA AND ANTIATHEROSCLEROSIS NISSHIN FLOUR MILLING CO., LTD. (JP) 1997-04-15 US disclosed
WO-1996039400-A1 AMINO-SUBSTITUTED THIADIAZOLES, PYRIMIDINES, TRIAZINES OR TRIAZOLES USEFUL AS CTF RECEPTOR ANTAGONISTS NEUROCRINE BIOSCIENCES, INC. (US) 1996-12-12 WO disclosed
EP-0703505-A1 Toner for two-component type developer MITA INDUSTRIAL CO., LTD. (JP) 1996-03-27 EP disclosed
EP-0625507-A2 Urea derivatives and their use as acat inhibitors NISSHIN FLOUR MILLING CO., LTD. (JP) 1994-11-23 EP disclosed
EP-0334845-B1 LIQUID CRYSTAL COMPOUNDS, MIXTURES AND DEVICES The Secretary of State for Defence in Her Britannic Majesty's Government of the United Kingdom of Great Britain and (GB) 1992-05-06 EP disclosed
US-5037576-A Ferroelectric; increased polarization THE SECRETARY OF STATE FOR DEFENCE IN HER BRITANNIC MAJESTY'S GOVERNMENT OF THE UNITED KINGDOM OF GREAT BRITAIN AND NORTHERN IRELAND (GB) 1991-08-06 US disclosed
WO-1988002390-A2 LIQUID CRYSTAL COMPOUNDS, MIXTURES AND DEVICES THE SECRETARY OF STATE FOR DEFENCE IN HER BRITANNI (GB) 1988-04-07 WO disclosed
CN-85104453-A Prepare a kind of method that is used for the treatment of the tetrahydro naphthols of hypertension 1986-12-10 CN 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-20120165587-A1 Method for Producing a Compound with a Double Bond ADH1C, ADH1A, ADH5 EPHX1 1502/4885SHBG 1682/4885TP53 3750/4885

“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.