SCHEMBL21690

SCHEMBL21690

Clc1ccc(N2CCOCC2)cc1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.66
SMN1; SMN2 Q16637 1/20 0.66
AKR1C3 P42330 1/20 0.65
HTR3E A5X5Y0 1/20 0.59
HTR3B O95264 1/20 0.59
ADRB1 P08588 1/20 0.59
HTR3A P46098 1/20 0.59
HTR3D Q70Z44 1/20 0.59
HTR3C Q8WXA8 1/20 0.59
SIGMAR1 Q99720 1/20 0.59
RAD51 Q06609 1/20 0.59
LMNA P02545 2/20 0.58
ALDH1A1 P00352 4/20 0.57
MEN1 O00255 2/20 0.57
HTT P42858 2/20 0.57
KMT2A Q03164 2/20 0.57
NPC1 O15118 1/20 0.57
CYP1A2 P05177 1/20 0.57
RAB9A P51151 1/20 0.57
PRKDC P78527 1/20 0.56

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
SCHEMBL17279011 0.88 MAPT (0.64) MAPTSMN1; SMN2AKR1C3HTR3EHTR3B
SCHEMBL9093746 0.87 LMNA (0.71) MAPTSMN1; SMN2LMNAALDH1A1MEN1
SCHEMBL14982082 0.85 MAPT (0.65) MAPTSMN1; SMN2AKR1C3LMNAALDH1A1
SCHEMBL2898914 0.85 MAPT (0.56) MAPTSMN1; SMN2AKR1C3HTR3EHTR3B
SCHEMBL870704 0.85 HTR3E (0.70) MAPTSMN1; SMN2AKR1C3HTR3EHTR3B
SCHEMBL29998630 0.85 HTR3E (0.70) MAPTSMN1; SMN2AKR1C3HTR3EHTR3B
SCHEMBL24103508 0.80 SIGMAR1 (0.64) MAPTSMN1; SMN2AKR1C3HTR3EHTR3B
SCHEMBL2175616 0.80 LMNA (0.62) MAPTSMN1; SMN2LMNAALDH1A1MEN1
SCHEMBL1822749 0.80 HTR3E (0.64) MAPTSMN1; SMN2AKR1C3HTR3EHTR3B
SCHEMBL1123884 0.80 MAPT (0.57) MAPTSMN1; SMN2AKR1C3LMNAALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113135835-A Method for exciting C-C bond breaking acylation and application 广州中医药大学(广州中医药研究院) 2021-07-20 CN claimed
CN-118271158-B Method for synthesizing deuterium-labeled substance containing deuterium atom structural unit 山东大学 2026-05-12 CN disclosed
CN-118271158-A Method for synthesizing deuterium-labeled substance containing deuterium atom structural unit 山东大学 2024-07-02 CN disclosed
CN-115215816-B Synthesis method of lactam compound 普济生物科技(台州)有限公司 2024-02-02 CN disclosed
WO-2023243522-A1 METHOD FOR PRODUCING AROMATIC COMPOUND 日本化学工業株式会社 2023-12-21 WO disclosed
CN-115215816-A Synthesis method of lactam compound 普济生物科技(台州)有限公司 2022-10-21 CN disclosed
WO-2022218348-A1 METHOD FOR SYNTHESIZING LACTAM COMPOUNDS Seasons Biotechnology (Taizhou) Co., Ltd. (CN) 2022-10-20 WO disclosed
CN-114786675-A Small molecule bromodomain inhibitors and uses thereof 康威基内有限公司 2022-07-22 CN disclosed
CN-113135835-B Method for exciting C-C bond breaking acylation and application 广州中医药大学(广州中医药研究院) 2022-07-01 CN disclosed
CN-113072460-B Morpholine derivative oxidation ring-opening method and product thereof 西南大学 2022-06-24 CN disclosed
WO-2013131609-A1 TRIAZOLOPYRAZINE DERIVATIVES MERCK PATENT GMBH (DE) 2013-09-12 WO disclosed
WO-2013124026-A1 8 - SUBSTITUTED 2 -AMINO - [1,2,4] TRIAZOLO [1, 5 -A] PYRAZINES AS SYK TRYROSINE KINASE INHIBITORS AND GCN2 SERIN KINASE INHIBITORS MERCK PATENT GMBH (DE) 2013-08-29 WO disclosed
US-20130225568-A1 TRIAZOLOPYRAZINE DERIVATIVES MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2013-08-29 US disclosed
EP-2609098-A1 TRIAZOLOPYRAZINE DERIVATIVES Merck Patent GmbH (DE) 2013-07-03 EP disclosed
CN-103068828-A Triazolopyrazine derivatives MERCK PATENT GMBH 2013-04-24 CN disclosed
CN-102532061-A Method for easily preparing aryl morpholine and aryl piperidine UNIV EAST CHINA SCIENCE & TECH 2012-07-04 CN disclosed
WO-2012025186-A1 TRIAZOLOPYRAZINE DERIVATIVES MERCK PATENT GMBH (DE) 2012-03-01 WO disclosed
US-5773437-A UROGENITAL DISORDERS SUCH AS DYSURIA NIPPON CHEMIPHAR CO., LTD. (JP) 1998-06-30 US disclosed
CN-1148853-A Alkylenediamine derivatives NIPPON CHEMIPHAR CO (JP) 1997-04-30 CN disclosed
CN-1024317-C Antifungal agents based on amides containing phenyl group RHONE POULENC AGROCHIMIE (FR) 1994-04-27 CN 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 (1 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-20130225568-A1 TRIAZOLOPYRAZINE DERIVATIVES SYK, IRAK1, ZAP70 MAPT 4687/4885SMN1; SMN2 4628/4885AKR1C3 2736/4885

“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.