SCHEMBL62990

SCHEMBL62990

O=C(O)CN1CCNCC1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 1/20 0.52
CHRM5 P08912 2/20 0.52
CHRM3 P20309 2/20 0.52
SIGMAR1 Q99720 6/20 0.47
CA2 P00918 2/20 0.39
CA12 O43570 1/20 0.39
CA1 P00915 1/20 0.39
CA9 Q16790 1/20 0.39
CHKA P35790 1/20 0.38
KDM5C P41229 1/20 0.38
KDM4C Q9H3R0 1/20 0.38
SLC6A9 P48067 1/20 0.37
POLB P06746 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37

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
SCHEMBL337070 1.00 HSD17B10 (0.52) HSD17B10CHRM5CHRM3SIGMAR1CA2
Hydrochloric Acid SCHEMBL31505485 0.98 CHRM5 (0.50) HSD17B10CHRM5CHRM3SIGMAR1CA2
Water SCHEMBL4953290 0.98 CHRM5 (0.50) HSD17B10CHRM5CHRM3SIGMAR1CA2
SCHEMBL29299554 0.98 CHRM5 (0.50) HSD17B10CHRM5CHRM3SIGMAR1CA2
SCHEMBL472190 0.98 CHRM5 (0.50) HSD17B10CHRM5CHRM3SIGMAR1CA2
SCHEMBL472213 0.98 CHRM5 (0.50) HSD17B10CHRM5CHRM3SIGMAR1CA2
Hydrochloric Acid SCHEMBL4441607 0.98 CHRM5 (0.50) HSD17B10CHRM5CHRM3SIGMAR1CA2
SCHEMBL306395 0.98 CHRM5 (0.50) HSD17B10CHRM5CHRM3SIGMAR1CA2
Hydrochloric Acid SCHEMBL1373260 0.98 CHRM5 (0.50) HSD17B10CHRM5CHRM3SIGMAR1CA2
SCHEMBL934786 0.98 CHRM5 (0.50) HSD17B10CHRM5CHRM3SIGMAR1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20260015393-A1 NOVEL NMU RECEPTOR 2 AGONISTS BOEHRINGER INGELHEIM INT (DE) 2026-01-15 US claimed
EP-4648849-A1 NMU RECEPTOR 2 AGONISTS Boehringer Ingelheim International GmbH (DE) 2025-11-19 EP claimed
US-20250339569-A1 CARBONIC ANHYDRASE IX LIGANDS 3B PHARMACEUTICALS GMBH (DE) 2025-11-06 US claimed
US-20250133947-A1 Thermal Evaporation-Growth of Halide Perovskites Through Phosphonic Acid Addition GEORGIA TECH RES INST (US) 2025-04-24 US claimed
CN-119752387-A Aldehyde-free polyurethane adhesive for high-conductivity leather products containing imidazole heterocycle ionic liquid and preparation method thereof 广东菲安妮皮具股份有限公司 2025-04-04 CN claimed
WO-2025063849-A2 DIMERIC FAP TARGETING AGENTS ERASMUS UNIVERSITY MEDICAL CENTER ROTTERDAM (NL) 2025-03-27 WO claimed
CN-119060466-B Preparation process of impact-resistant insulating plate 山东澳兴绝缘材料有限公司 2025-01-10 CN claimed
CN-119060466-A Preparation process of impact-resistant insulating plate 山东澳兴绝缘材料有限公司 2024-12-03 CN claimed
EP-4448544-A2 CARBONIC ANHYDRASE IX LIGANDS 3B Pharmaceuticals GmbH (DE) 2024-10-23 EP claimed
US-20240279278-A1 NMU RECEPTOR 2 AGONISTS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2024-08-22 US claimed
EP-1587795-A1 N- (1-BENZYL-2-OXO-2- (1-PIPERAZINYL) ETHYL) -1-PIPERIDINCARBOXAMID-DERIVATIVES AND RELATED COMPOUNDS USE AS CGRP-ANTAGONISTS FOR TREATING A HEADACHE Boehringer Ingelheim International GmbH (DE) 2005-10-26 EP claimed
US-20040253225-A1 bombesin, derivatives and/or analogues capable of complexing metal ions, radionuclides or optical labels, for use in radiotherapy BRACCO IMAGING S.P.A. (IT) 2004-12-16 US claimed
WO-2004063171-A1 N- (1-BENZYL-2-OXO-2- (1-PIPERAZINYL) ETHYL) -1-PIPERIDINCARBOXAMID-DERIVATIVES AND RELATED COMPOUNDS USE AS CGRP-ANTAGONISTS FOR TREATING A HEADACHE BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2004-07-29 WO claimed
US-20040136906-A1 Gastrin releasing peptide compounds BRACCO IMAGING S.P.A. (IT) 2004-07-15 US claimed
EP-0790974-B1 SUBSTITUTED 4-BIARYLBUTYRIC OR 5-BIARYLPENTANOIC ACIDS AND DERIVATIVES AS MATRIX METALLOPROTEASE INHIBITIORS BAYER AG (US) 2002-08-14 EP claimed
US-6147183-A Amphoteric amine based polymers having a net cationic charge and process for their production BASF AKTIENGESELLSCHAFT (DE) 2000-11-14 US claimed
US-5614535-A Adhesion receptor antagonists MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1997-03-25 US claimed
EP-0147608-B2 PROCESS FOR THE PREPARATION OF TITANIUM DIOXIDE BAYER AG (DE) 1991-04-17 EP claimed
EP-0147608-B1 PROCESS FOR THE PREPARATION OF TITANIUM DIOXIDE BAYER AG (DE) 1987-08-12 EP claimed
US-4663131-A Process for the preparation of titanium dioxide BAYER AKTIENGESELLSCHAFT (DE) 1987-05-05 US claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (5 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-20260015393-A1 NOVEL NMU RECEPTOR 2 AGONISTS NMUR2, NMUR1, GPR18 HSD17B10 2488/4885CHRM5 210/4885CHRM3 100/4885
US-20040253225-A1 bombesin, derivatives and/or analogues capable of complexing metal ions, radionuclides or optical labels, for use in radiotherapy GRPR, MLNR, NPBWR1 HSD17B10 4878/4885CHRM5 442/4885CHRM3 286/4885
US-20240279278-A1 NMU RECEPTOR 2 AGONISTS NMUR2, NMUR1, NMBR HSD17B10 3645/4885CHRM5 161/4885CHRM3 190/4885
US-20250339569-A1 CARBONIC ANHYDRASE IX LIGANDS CA9, CA13, CA4 HSD17B10 3729/4885CHRM5 3957/4885CHRM3 3959/4885
US-20040136906-A1 Gastrin releasing peptide compounds GRPR, GIPR, MLNR HSD17B10 4863/4885CHRM5 1036/4885CHRM3 1037/4885

“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.