SCHEMBL230405

SCHEMBL230405

COc1ccc(C(=O)C2CCNCC2)cc1

nearest known ligand 0.71

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.71
RAB9A P51151 1/20 0.71
KMT2A Q03164 4/20 0.66
MEN1 O00255 2/20 0.66
CYP2D6 P10635 1/20 0.66
POLB P06746 1/20 0.61
ALDH1A1 P00352 5/20 0.57
SMN1; SMN2 Q16637 4/20 0.57
LMNA P02545 4/20 0.56
HSD11B1 P28845 1/20 0.55
MGLL Q99685 1/20 0.55
GAA P10253 1/20 0.51
MAPK1 P28482 1/20 0.51
CHRM2 P08172 2/20 0.49
CHRM4 P08173 2/20 0.49
CHRM1 P11229 2/20 0.49
CHRM3 P20309 2/20 0.49
TSHR P16473 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 SCHEMBL518416 0.98 KMT2A (0.69) NPC1RAB9AKMT2AMEN1CYP2D6
Bromide SCHEMBL7247705 0.98 NPC1 (0.69) NPC1RAB9AKMT2AMEN1CYP2D6
SCHEMBL1148371 0.88 NPC1 (0.89) NPC1RAB9AKMT2AMEN1POLB
SCHEMBL5350428 0.88 NPC1 (0.89) NPC1RAB9AKMT2AMEN1POLB
SCHEMBL5350433 0.88 NPC1 (0.89) NPC1RAB9AKMT2AMEN1POLB
SCHEMBL9136904 0.84 NPC1 (0.77) NPC1RAB9AKMT2AMEN1POLB
SCHEMBL3367257 0.84 NPC1 (0.77) NPC1RAB9AKMT2AMEN1POLB
Bicarbonate SCHEMBL11475731 0.84 NPC1 (0.83) NPC1RAB9AKMT2AMEN1POLB
SCHEMBL6208933 0.84 CES2 (0.57) NPC1RAB9AKMT2AMEN1CYP2D6
SCHEMBL13944265 0.83 MEN1 (0.66) NPC1RAB9AKMT2AMEN1CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4567102-A1 METHODS FOR ISOLATING EMBRYONIC STEM CELLS FROM AVIAN EMBRYONIC CELLS Suprême (FR) 2025-06-11 EP disclosed
CN-119798161-A Preparation method of plant growth regulating substance and multiple uses thereof 贵州工业职业技术学院 2025-04-11 CN disclosed
WO-2022083679-A1 PRODRUGS FOR SUSTAINED RELEASING THERAPEUTIC AGENTS AND USES THEREOF LIANGJIANG MEDICINE CO., LTD. (CN) 2022-04-28 WO disclosed
CN-108137556-B 1, 4-dicarbonyl-piperidinyl derivatives 默克专利股份公司 2021-07-30 CN disclosed
US-10570116-B2 1,4-dicarbonyl-piperidyl derivatives MERCK PATENT GMBH (DE) 2020-02-25 US disclosed
EP-3371166-B1 1,4-DICARBONYL-PIPERIDYL DERIVATIVES MERCK PATENT GMBH (DE) 2019-11-20 EP disclosed
US-10300155-B2 Alpha-synuclein ligands WASHINGTON UNIVERSITY (US) 2019-05-28 US disclosed
US-10300155-B2 Alpha-synuclein ligands WASHINGTON UNIVERSITY (US) 2019-05-28 US disclosed
US-20190092751-A1 1,4-DICARBONYL-PIPERIDYL DERIVATIVES MERCK PATENT GMBH (DE) 2019-03-28 US disclosed
EP-3371166-A1 1,4-DICARBONYL-PIPERIDYL DERIVATIVES Merck Patent GmbH (DE) 2018-09-12 EP disclosed
EP-0574846-A2 Imidazopyridines as angiotensin II antagonistes MERCK PATENT GmbH (DE) 1993-12-22 EP disclosed
EP-0557526-A1 PYRROLOAZEPINE COMPOUND SUNTORY LIMITED (JP) 1993-09-01 EP disclosed
US-5206239-A Cardiovascular disorders SUNTORY LIMITED (JP) 1993-04-27 US disclosed
US-5198449-A N-substituted alpha-arylazacycloalkylmethanamines and their use as cardiovascular agents A. H. ROBINS COMPANY INCORPORATED (US) 1993-03-30 US disclosed
EP-0441349-A1 Pyrroloazepine derivatives SUNTORY LIMITED (JP) 1991-08-14 EP disclosed
US-4547513-A ANTIARRHYTHMIA AND ANTITHROMBOGENIC AGENTS SANTEN PHARMACEUTICAL CO., LTD. (JP) 1985-10-15 US disclosed
US-4110459-A ANALGESIC AMERICAN HOECHST CORPORATION (US) 1978-08-29 US disclosed
US-4101663-A ANTIHYPERTENSIVES AMERICAN HOECHST CORPORATION (US) 1978-07-18 US disclosed
US-4046900-A TRANQUILIZERS, HYPOTENSIVES, ANALGESICS AMERICAN HOECHST CORPORATION (US) 1977-09-06 US disclosed
US-3968217-A ANTIDEPRESSANT A. H. ROBINS COMPANY, INCORPORATED (US) 1976-07-06 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 (3 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-10570116-B2 1,4-dicarbonyl-piperidyl derivatives TNKS, TANK, TBKBP1 NPC1 3309/4885RAB9A 3163/4885KMT2A 530/4885
US-10300155-B2 Alpha-synuclein ligands SNCA, PARK7, LRRK2 NPC1 382/4885RAB9A 152/4885KMT2A 4633/4885
US-20190092751-A1 1,4-DICARBONYL-PIPERIDYL DERIVATIVES TNKS, TANK, TBKBP1 NPC1 3309/4885RAB9A 3163/4885KMT2A 530/4885

“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.