SCHEMBL1703645

SCHEMBL1703645

NC[C@H]1CCC[C@H](CN)C1

nearest known ligand 0.61

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 1/20 0.39
NCF1 P14598 1/20 0.38
CYP2D6 P10635 1/20 0.37
SIGMAR1 Q99720 1/20 0.35
PLG P00747 1/20 0.35
PLAT P00750 1/20 0.35
LMNA P02545 1/20 0.35
HRH4 Q9H3N8 2/20 0.32
ALOX5 P09917 1/20 0.32
HTR2C P28335 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
SCHEMBL26661 1.00 EPHX2 (0.39) EPHX2NCF1CYP2D6SIGMAR1PLG
SCHEMBL467954 1.00 EPHX2 (0.39) EPHX2NCF1CYP2D6SIGMAR1PLG
SCHEMBL7135021 1.00 EPHX2 (0.39) EPHX2NCF1CYP2D6SIGMAR1PLG
SCHEMBL1703647 1.00 EPHX2 (0.39) EPHX2NCF1CYP2D6SIGMAR1PLG
Hydrochloric Acid SCHEMBL25223266 0.97 EPHX2 (0.37) EPHX2NCF1CYP2D6SIGMAR1PLG
Ammonia Solution, Strong SCHEMBL9620353 0.97 EPHX2 (0.37) EPHX2NCF1CYP2D6SIGMAR1PLG
Ammonia Solution, Strong SCHEMBL20562887 0.97 EPHX2 (0.37) EPHX2NCF1CYP2D6SIGMAR1PLG
Hydrochloric Acid SCHEMBL9438734 0.97 EPHX2 (0.37) EPHX2NCF1CYP2D6SIGMAR1PLG
SCHEMBL5249610 0.94 PLG (0.42) EPHX2NCF1CYP2D6SIGMAR1PLG
SCHEMBL25602681 0.93 CYP2D6 (0.41) EPHX2NCF1CYP2D6SIGMAR1PLG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110982034-A 1, 3-diisocyanatomethylcyclohexane composition and optical resin prepared from same 万华化学集团股份有限公司 2020-04-10 CN claimed
EP-2626344-B1 METHOD FOR PRODUCING TRANS-1,4-BIS(AMINOMETHYL)CYCLOHEXANE MITSUI CHEMICALS INC (JP) 2019-05-15 EP claimed
EP-2094759-B1 EPOXY RESINS COMPRISING A CYCLOALIPHATIC DIAMINE CURING AGENT DOW GLOBAL TECHNOLOGIES LLC (US) 2012-04-18 EP claimed
US-20100029894-A1 POLYAMIDE POLYMER DOW GLOBAL TECHNOLOGIES LLC 2010-02-04 US claimed
US-12597655-B2 Device for cooling and/or heating a battery of an electric or hybrid motor vehicle ARKEMA FRANCE (FR) 2026-04-07 US disclosed
EP-3907247-B1 GLASS TRANSITION HIGH-TEMPERATURE SEMI-CRYSTALLINE POLYAMIDE COMPOSITION MADE OF NEAR-FIELD DIAMINE FOR THERMOPLASTIC MATERIAL, METHOD FOR MANUFACTURING SAME AND USES THEREOF ARKEMA FRANCE (FR) 2023-08-16 EP disclosed
EP-3133108-B1 FIBER-REINFORCED COMPOSITE MATERIAL MITSUBISHI GAS CHEMICAL CO (JP) 2023-08-02 EP disclosed
CN-111164783-B Battery compartment 阿科玛法国公司 2022-12-09 CN disclosed
US-11417929-B2 Battery compartment ARKEMA FRANCE (FR) 2022-08-16 US disclosed
CN-113874418-A Polyimide, polyamic acid, resin solution, coating agent, and polyimide film 引能仕株式会社 2021-12-31 CN disclosed
CN-110982034-B 1, 3-diisocyanatomethylcyclohexane composition and optical resin prepared from same 万华化学集团股份有限公司 2021-07-23 CN disclosed
WO-2021103550-A1 1,3-BISISOCYANATOMETHYLCYCLOHEXANE COMPOSITION AND OPTICAL RESIN PREPARED THEREFROM 万华化学集团股份有限公司 2021-06-03 WO disclosed
EP-0693515-B1 Process for the preparation of precondensates of semi-crystalline or amorphous semi-aromatic thermoplastic (co)polyamides INVENTA AG (CH) 1998-12-09 EP disclosed
US-5708125-A Process for producing precondensates of partially crystalline or amorphous, thermoplastically processable, partially aromatic polyamides or copolyamides EMS-INVENTA AG (CH) 1998-01-13 US disclosed
EP-0693515-A1 Process for the preparation of precondensates of semi-crystalline or amorphous semi-aromatic thermoplastic (co)polyamides EMS-INVENTA AG (CH) 1996-01-24 EP disclosed
US-4071506-A Crystal-clear polyamides from 1,3-bis(aminomethyl)cyclohexane HOECHST AKTIENGESELLSCHAFT (DT) 1978-01-31 US disclosed
US-4062828-A PHOSPHINYLPHOSPHINIC ACID HOECHST AKTIENGESELLSCHAFT (DT) 1977-12-13 US disclosed
US-4014957-A Thermoplastic polyamide moulding compositions HOECHST AKTIENGESELLSCHAFT (DT) 1977-03-29 US disclosed
US-3992360-A Transparent polyamides from 1,3-bis-(aminomethyl)-cyclohexane and aliphatic amino carboxylic acid HOECHST AKTIENGESELLSCHAFT (DT) 1976-11-16 US disclosed
US-3974234-A IMPACT STRENGTH HOECHST AKTIENGESELLSCHAFT (DT) 1976-08-10 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-12597655-B2 Device for cooling and/or heating a battery of an electric or hybrid motor vehicle KIF5B, HSPB1, MYO3A EPHX2 1648/4885NCF1 2690/4885CYP2D6 2844/4885

“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.