SCHEMBL646456

SCHEMBL646456

NC(C1CCCCC1)C(N)C1CCCCC1

nearest known ligand 0.58

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 2/20 0.48
TP53 P04637 1/20 0.43
KDM4E B2RXH2 1/20 0.42
GMNN O75496 1/20 0.42
LMNA P02545 1/20 0.42
MAPT P10636 1/20 0.42
BLM P54132 1/20 0.42
PMP22 Q01453 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
SHBG P04278 1/20 0.41
DPP4 P27487 2/20 0.39

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
SCHEMBL1900865 1.00 EPHX1 (0.48) EPHX1TP53KDM4EGMNNLMNA
SCHEMBL29257688 1.00 EPHX1 (0.48) EPHX1TP53KDM4EGMNNLMNA
SCHEMBL2067136 1.00 EPHX1 (0.48) EPHX1TP53KDM4EGMNNLMNA
SCHEMBL3293988 1.00 EPHX1 (0.48) EPHX1TP53KDM4EGMNNLMNA
SCHEMBL1900915 1.00 EPHX1 (0.48) EPHX1TP53KDM4EGMNNLMNA
SCHEMBL13416816 0.82 EPHX1 (0.40) EPHX1TP53KDM4EGMNNLMNA
SCHEMBL16316581 0.82 EPHX1 (0.40) EPHX1TP53KDM4EGMNNLMNA
SCHEMBL5509761 0.82 EPHX1 (0.40) EPHX1TP53KDM4EGMNNLMNA
SCHEMBL19538503 0.82 TP53 (0.48) EPHX1TP53KDM4EGMNNLMNA
SCHEMBL14299180 0.82 EPHX1 (0.40) EPHX1TP53KDM4EGMNNLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118239988-A Preparation method and application of heterochiral binuclear Ir (III) metal-organic double-helix structure compound 大连理工大学 2024-06-25 CN claimed
US-20240166814-A1 POLYESTERAMIDE RESIN, MANUFACTURING METHOD OF THE SAME, AND BIAXIALLY STRETCHED FILM INCLUDING THE SAME SK CHEMICALS CO., LTD. (KR) 2024-05-23 US claimed
CN-114437136-A Preparation method and application of thiourea functionalized multi-chiral dual-core Ir (III) metal-organic double helix structure 大连理工大学 2022-05-06 CN claimed
CN-100584460-C Catalyst for asymmetric (transfer) hydrogenation DSM IP ASSETS BV 2010-01-27 CN claimed
CN-1974010-A Catalyst for asymmetric (transfer) hydrogenation DSM IP ASSETS BV (NL) 2007-06-06 CN claimed
CN-1827214-A Catalyst for asymmetric (transfer) hydrogenation DSM IP ASSETS BV (NL) 2006-09-06 CN claimed
US-20240166814-A1 POLYESTERAMIDE RESIN, MANUFACTURING METHOD OF THE SAME, AND BIAXIALLY STRETCHED FILM INCLUDING THE SAME SK CHEMICALS CO., LTD. (KR) 2024-05-23 US disclosed
WO-2024085502-A1 RESIN COMPOSITION COMPRISING POLYESTERAMIDE RESIN AND MOLDED ARTICLE THEREOF 에스케이케미칼 주식회사 2024-04-25 WO disclosed
CN-114437136-B Preparation method and application of thiourea functionalized multi-chiral binuclear Ir (III) metal-organic double helix structure 大连理工大学 2023-06-27 CN disclosed
WO-2022235008-A1 POLYESTERAMIDE RESIN, MANUFACTURING METHOD THEREOF, AND BIAXIALLY STRETCHED FILM INCLUDING SAME 에스케이케미칼 주식회사 2022-11-10 WO disclosed
CN-114437136-A Preparation method and application of thiourea functionalized multi-chiral dual-core Ir (III) metal-organic double helix structure 大连理工大学 2022-05-06 CN disclosed
WO-2021223156-A1 DIBORON GLYCOL ESTER, PREPARATION METHOD THEREFOR, INTERMEDIATE THEREOF, AND APPLICATION THEREOF 中国科学院上海有机化学研究所 2021-11-11 WO disclosed
EP-1970360-B1 Method for producing alcohols TAKASAGO PERFUMERY CO LTD (JP) 2016-08-31 EP disclosed
CN-1827214-A Catalyst for asymmetric (transfer) hydrogenation DSM IP ASSETS BV (NL) 2006-09-06 CN disclosed
US-20060047122-A1 Process for producing optically active-3-quinuclidinols TAKASAGO INTERNATIONAL CORPORATION (JP) 2006-03-02 US disclosed
EP-1136475-B1 Piperidine and piperazine compounds for use in the treatment of Alzheimer HOFFMANN LA ROCHE (CH) 2004-08-18 EP disclosed
EP-1136475-B1 Piperidine and piperazine compounds for use in the treatment of Alzheimer HOFFMANN LA ROCHE (CH) 2004-08-18 EP disclosed
US-6605723-B2 Reacting a protected amino acid ester with a 4-substituted butyric acid derivative, cyclizing the protected intermediate, benzylating and decarboxylating the intermediate, asymmetric hydrogenation using a catalyst HOFFMAN-LA ROCHE INC. 2003-08-12 US disclosed
US-20010037026-A1 Process for the preparation of ethanesul fonyl-piperidine derivatives EVOTEC INTERNATIONAL GMBH (DE) 2001-11-01 US disclosed
EP-1136475-A1 Piperidine and piperazine compounds for use in the treatment of Alzheimer F. HOFFMANN-LA ROCHE AG (CH) 2001-09-26 EP 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 (2 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-20010037026-A1 Process for the preparation of ethanesul fonyl-piperidine derivatives GRIN1, GRIN3A, GRIN2B EPHX1 1164/4885TP53 4650/4885KDM4E 1121/4885
US-20060047122-A1 Process for producing optically active-3-quinuclidinols DHPS, QDPR, TYR EPHX1 4496/4885TP53 4477/4885KDM4E 898/4885

“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.