SCHEMBL8258502

SCHEMBL8258502

CC(=O)C1CCN(C(C)C)CC1

nearest known ligand 0.45

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ HRH3 Q9Y5N1 10/20 0.45
▸ KCNH2 Q12809 4/20 0.42
▸ CYP2D6 P10635 2/20 0.42
▸ ALDH1A1 P00352 1/20 0.39
▸ CHRNA7 P36544 1/20 0.34
▸ MEN1 O00255 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ SMN1; SMN2 Q16637 1/20 0.34
▸ GSK3B P49841 2/20 0.33
▸ DYRK1A Q13627 2/20 0.33
▸ WNT1 P04628 1/20 0.33
▸ F10 P00742 1/20 0.33

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
SCHEMBL26724728 0.92 HRH3 (0.42) HRH3KCNH2CYP2D6ALDH1A1CHRNA7
SCHEMBL22212237 0.90 HRH3 (0.44) HRH3KCNH2CYP2D6ALDH1A1CHRNA7
SCHEMBL25075065 0.89 HRH3 (0.41) HRH3KCNH2CYP2D6MEN1KMT2A
SCHEMBL27420755 0.87 HRH3 (0.42) HRH3KCNH2CYP2D6ALDH1A1MEN1
SCHEMBL21779855 0.87 HRH3 (0.42) HRH3KCNH2CYP2D6ALDH1A1MEN1
SCHEMBL14265647 0.87 HRH3 (0.42) HRH3KCNH2CYP2D6ALDH1A1MEN1
SCHEMBL19457302 0.86 SMN1; SMN2 (0.34) HRH3KCNH2CYP2D6ALDH1A1MEN1
SCHEMBL28298138 0.84 HRH3 (0.46) HRH3KCNH2CYP2D6ALDH1A1CHRNA7
SCHEMBL25075220 0.83 HRH3 (0.41) HRH3KCNH2CYP2D6SMN1; SMN2
SCHEMBL1874567 0.82 HRH3 (0.45) HRH3KCNH2CYP2D6ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240239774-A1 SOLUBLE ADENYLYL CYCLASE (SAC) INHIBITORS AND USES THEREOF CORNELL UNIVERSITY (US) 2024-07-18 — — US disclosed
US-20240239813-A1 KRAS INHIBITORS AND PHARMACEUTICAL USES THEREOF Risen (Suzhou) Pharma Tech Co., Ltd. (CN) 2024-07-18 — — US disclosed
US-11873291-B2 Quinoline cGAS antagonist compounds IMMUNESENSOR THERAPEUTICS, INC. (US) 2024-01-16 — — US disclosed
US-11834447-B2 Indole derivatives and use thereof PURDUE PHARMA L.P. (US) 2023-12-05 — — US disclosed
US-20230357158-A1 QUINOLINE cGAS ANTAGONIST COMPOUNDS THE BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM 2023-11-09 — — US disclosed
WO-2023142600-A1 AMINO LIPID, PREPARATION METHOD THEREFOR, AND USE THEREOF 深圳虹信生物科技有限公司 2023-08-03 — — WO disclosed
US-20230242514-A1 BICYCLIC INDAZOLE GLUCOCORTICOID RECEPTOR ANTAGONISTS CORCEPT THERAPEUTICS INCORPORATED 2023-08-03 — — US disclosed
EP-4215188-A1 AN AMINO LIPID, PREPARATION METHOD AND APPLICATION THEREOF Shenzhen MagicRNA Biotechnology Co., Ltd. (CN) 2023-07-26 — — EP disclosed
US-20230143470-A1 SMALL MOLECULE INHIBITORS OF INFLUENZA HEMAGGLUTININ NATIONAL INSTITUTES OF HEALTH 2023-05-11 — — US disclosed
US-20230024096-A1 BIFUNCTIONAL COMPOUNDS FOR THE TREATMENT OF CANCER C4 THERAPEUTICS, INC. 2023-01-26 — — US disclosed
US-7696352-B2 Factor Xa inhibitors MILLENNIUM PHARMACEUTICALS, INC. (US) 2010-04-13 — — US disclosed
WO-2009138440-A1 CARBAMOYL DERIVATIVES OF BICYCLIC CARBONYLAMINO-PYRAZOLES AS PRODRUGS NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2009-11-19 — — WO disclosed
US-20080275085-A1 Piperidine derivative and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-11-06 — — US disclosed
US-20080275085-A1 Piperidine derivative and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-11-06 — — US disclosed
US-7256186-B2 Gamma secretase inhibitors SCHERING CORPORATION (US) 2007-08-14 — — US disclosed
US-7208602-B2 Gamma secretase inhibitors SCHERING CORPORATION (US) 2007-04-24 — — US disclosed
US-20070072865-A1 Bicyclic piperazine compound and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2007-03-29 — — US disclosed
US-20070072865-A1 Bicyclic piperazine compound and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2007-03-29 — — US disclosed
US-20050085506-A1 Novel gamma secretase inhibitors SCHERING-PLOUGH CORPORATION AND PHARMACOPEIA, INC. 2005-04-21 — — US disclosed
US-20040171614-A1 Novel gamma secretase inhibitors SCHERING-PLOUGH CORPORATION 2004-09-02 — — 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 (12 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-20040171614-A1 Novel gamma secretase inhibitors BACE1, BACE2, APP HRH3 789/4885KCNH2 2312/4885CYP2D6 3159/4885
US-11834447-B2 Indole derivatives and use thereof TRPC4, TRPV4, TRPV1 HRH3 659/4885KCNH2 64/4885CYP2D6 489/4885
US-11873291-B2 Quinoline cGAS antagonist compounds CGAS, GLS2, GLS HRH3 994/4885KCNH2 3146/4885CYP2D6 1699/4885
US-20240239774-A1 SOLUBLE ADENYLYL CYCLASE (SAC) INHIBITORS AND USES THEREOF UACA, ADCYAP1R1, ADCY1 HRH3 2176/4885KCNH2 3575/4885CYP2D6 1242/4885
US-20080275085-A1 Piperidine derivative and use thereof TACR2, TACR1, PRLHR HRH3 43/4885KCNH2 48/4885CYP2D6 3856/4885
US-20230357158-A1 QUINOLINE cGAS ANTAGONIST COMPOUNDS CGAS, GLS2, GLS HRH3 994/4885KCNH2 3146/4885CYP2D6 1699/4885
US-20230242514-A1 BICYCLIC INDAZOLE GLUCOCORTICOID RECEPTOR ANTAGONISTS NR3C1, NR3C2, NR1I2 HRH3 1649/4885KCNH2 2637/4885CYP2D6 210/4885
US-20050085506-A1 Novel gamma secretase inhibitors BACE1, BACE2, APP HRH3 278/4885KCNH2 3247/4885CYP2D6 2438/4885
US-20070072865-A1 Bicyclic piperazine compound and use thereof GPR3, FFAR3, LPAR3 HRH3 82/4885KCNH2 856/4885CYP2D6 2309/4885
US-20240239813-A1 KRAS INHIBITORS AND PHARMACEUTICAL USES THEREOF KRAS, NRAS, HRAS HRH3 3426/4885KCNH2 4693/4885CYP2D6 2058/4885
US-20230024096-A1 BIFUNCTIONAL COMPOUNDS FOR THE TREATMENT OF CANCER SMARCC1, SMARCC2, SMARCA2 HRH3 3573/4885KCNH2 4590/4885CYP2D6 4266/4885
US-20230143470-A1 SMALL MOLECULE INHIBITORS OF INFLUENZA HEMAGGLUTININ HAVCR2, CD44, ENGASE HRH3 13/4885KCNH2 3229/4885CYP2D6 4663/4885

“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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