SCHEMBL3811903

SCHEMBL3811903

O=C(O)N(Cc1ccccc1)C1CCNCC1

nearest known ligand 0.61

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ DCUN1D1 Q96GG9 1/20 0.58
▸ SLC6A2 P23975 5/20 0.58
▸ SLC6A4 P31645 5/20 0.58
▸ SLC6A3 Q01959 3/20 0.58
▸ KCNH2 Q12809 2/20 0.56
▸ CTSD P07339 1/20 0.53
▸ AGER Q15109 3/20 0.50
▸ MTNR1A P48039 1/20 0.50
▸ CHRM2 P08172 1/20 0.50
▸ CHRM3 P20309 1/20 0.50
▸ TACR1 P25103 4/20 0.49
▸ OPRM1 P35372 3/20 0.49
▸ GBA1 P04062 1/20 0.49

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
Hydrochloric Acid SCHEMBL21410210 0.98 DCUN1D1 (0.57) DCUN1D1SLC6A2SLC6A4SLC6A3KCNH2
SCHEMBL619150 0.91 SLC6A2 (0.71) DCUN1D1SLC6A2SLC6A4SLC6A3KCNH2
SCHEMBL6622412 0.91 DCUN1D1 (0.54) DCUN1D1SLC6A2SLC6A4SLC6A3KCNH2
SCHEMBL476886 0.90 SLC6A2 (0.60) SLC6A2SLC6A4SLC6A3KCNH2CTSD
SCHEMBL476885 0.90 SLC6A2 (0.60) SLC6A2SLC6A4SLC6A3KCNH2CTSD
SCHEMBL18342235 0.90 SLC6A2 (0.60) SLC6A2SLC6A4SLC6A3KCNH2CTSD
Hydrochloric Acid SCHEMBL22797899 0.89 SLC6A2 (0.70) DCUN1D1SLC6A2SLC6A4SLC6A3KCNH2
SCHEMBL4198203 0.89 OPRM1 (0.62) DCUN1D1SLC6A2SLC6A4SLC6A3KCNH2
SCHEMBL3370759 0.89 AGER (0.55) DCUN1D1CTSDAGERMTNR1ACHRM2
Oxalic Acid SCHEMBL1624804 0.87 SLC6A2 (0.57) SLC6A2SLC6A4SLC6A3KCNH2CTSD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118561742-A Rupestonic acid amide derivative containing nitrogen heterocycle, and preparation method and application thereof 中国科学院新疆理化技术研究所 2024-08-30 — — CN claimed
WO-2025108255-A1 POLYCYCLIC DERIVATIVE, AND PREPARATION METHOD THEREFOR AND USE THEREOF 上海齐鲁制药研究中心有限公司 2025-05-30 — — WO disclosed
US-20240360149-A1 COMPOUND WITH ANTICANCER ACTIVITY KYOWA KIRIN CO., LTD. (JP) 2024-10-31 — — US disclosed
CN-118561742-A Rupestonic acid amide derivative containing nitrogen heterocycle, and preparation method and application thereof 中国科学院新疆理化技术研究所 2024-08-30 — — CN disclosed
US-12054494-B2 Compound with anticancer activity KYOWA KIRIN CO., LTD. (JP) 2024-08-06 — — US disclosed
US-11970448-B2 Monomers capable of dimerizing in an aqueous solution, and methods of using same CORNELL UNIVERSITY (US) 2024-04-30 — — US disclosed
EP-3778573-B1 COMPOUND WITH ANTICANCER ACTIVITY KYOWA KIRIN CO LTD (JP) 2024-04-24 — — EP disclosed
CN-116783205-A Compounds for degradation of cyclin-dependent kinase 2 via the ubiquitin proteasome pathway 尼坎治疗公司 2023-09-19 — — CN disclosed
US-20230159554-A1 COMPOUND WITH ANTICANCER ACTIVITY KYOWA KIRIN CO., LTD. (JP) 2023-05-25 — — US disclosed
US-11629152-B2 Compound with anticancer activity KYOWA KIRIN CO., LTD. (JP) 2023-04-18 — — US disclosed
US-7544325-B2 BIER vessel high-speed biological indicator shuttling system AMERICAN STERILIZER COMPANY (US) 2009-06-09 — — US disclosed
US-7449581-B2 6-Substituted pyrido-pyrimidines POCHE PALO ALTO LLC (US) 2008-11-11 — — US disclosed
EP-1945606-A1 ALKYLCARBAMOYL NAPHTHALENYLOXY- OCTENOYLHYDROXYAMIDE DERIVATIVES HAVING INHIBITORY ACTIVITY AGAINST HISTONE DEACETYLASE AND PREPARATION THEREOF Korea Research Institute of Chemical Technology (KR) 2008-07-23 — — EP disclosed
WO-2008054154-A1 NAPHTHALENYLOXYPROPENYL DERIVATIVES HAVING INHIBITORY ACTIVITY AGAINST HISTONE DEACETYLASE AND PHARMACEUTICAL COMPOSITION COMPRISING THE SAME KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 2008-05-08 — — WO disclosed
US-20070135458-A1 6-Substituted pyrido-pyrimidines CHEN JIAN J 2007-06-14 — — US disclosed
WO-2007052938-A1 ALKYLCARBAMOYL NAPHTHALENYLOXY- OCTENOYLHYDROXYAMIDE DERIVATIVES HAVING INHIBITORY ACTIVITY AGAINST HISTONE DEACETYLASE AND PREPARATION THEREOF KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 2007-05-10 — — WO disclosed
US-7169794-B2 6-substituted pyrido-pyrimidines ROCHE PALO ALTO LLC (US) 2007-01-30 — — US disclosed
US-6967196-B1 Sulfonamide compounds and uses thereof BRISTOL-MYERS SQUIBB COMPANY (US) 2005-11-22 — — US disclosed
US-20050112026-A1 BIER vessel high-speed biological indicator shuttling system STERIS INC. 2005-05-26 — — US disclosed
US-20040116698-A1 6-Substituted pyrido-pyrimidines CHEN JIAN JEFFREY (US) 2004-06-17 — — 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 (6 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-11970448-B2 Monomers capable of dimerizing in an aqueous solution, and methods of using same CALCOCO2, MDN1, MBNL1 DCUN1D1 215/4885SLC6A2 4846/4885SLC6A4 4761/4885
US-20070135458-A1 6-Substituted pyrido-pyrimidines P2RX6, P2RX1, P2RX7 DCUN1D1 1209/4885SLC6A2 3706/4885SLC6A4 3005/4885
US-12054494-B2 Compound with anticancer activity TP53, H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, RCC2 DCUN1D1 633/4885SLC6A2 2301/4885SLC6A4 3482/4885
US-20230159554-A1 COMPOUND WITH ANTICANCER ACTIVITY TP53, H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, RCC2 DCUN1D1 633/4885SLC6A2 2301/4885SLC6A4 3482/4885
US-11629152-B2 Compound with anticancer activity TP53, H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, RCC2 DCUN1D1 633/4885SLC6A2 2301/4885SLC6A4 3482/4885
US-20240360149-A1 COMPOUND WITH ANTICANCER ACTIVITY TP53, H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, RCC2 DCUN1D1 633/4885SLC6A2 2301/4885SLC6A4 3482/4885

“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.

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