SCHEMBL4122

SCHEMBL4122

c1ccc(C2CCNC2)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SLC18A3 Q16572 2/20 0.75
SIGMAR1 Q99720 1/20 0.75
HTR3A P46098 1/20 0.64
JAK3 P52333 2/20 0.60

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
SCHEMBL495695 1.00 SLC18A3 (0.75) SLC18A3SIGMAR1HTR3AJAK3
SCHEMBL495697 1.00 SLC18A3 (0.75) SLC18A3SIGMAR1HTR3AJAK3
Hydrochloric Acid SCHEMBL4573453 0.98 SLC18A3 (0.72) SLC18A3SIGMAR1HTR3AJAK3
Hydrochloric Acid SCHEMBL2173028 0.98 SLC18A3 (0.72) SLC18A3SIGMAR1HTR3AJAK3
Hydrochloric Acid SCHEMBL2175594 0.98 SLC18A3 (0.72) SLC18A3SIGMAR1HTR3AJAK3
Hydrochloric Acid SCHEMBL30098419 0.98 SLC18A3 (0.72) SLC18A3SIGMAR1HTR3AJAK3
Methylene Chloride SCHEMBL28313080 0.92 SLC18A3 (0.64) SLC18A3SIGMAR1HTR3AJAK3
SCHEMBL28296851 0.90 SLC18A3 (0.62) SLC18A3SIGMAR1HTR3AJAK3
SCHEMBL28298515 0.90 SLC18A3 (0.62) SLC18A3SIGMAR1HTR3AJAK3
SCHEMBL28298504 0.90 SLC18A3 (0.62) SLC18A3SIGMAR1HTR3AJAK3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-120035580-A Novel piperazinyl sulfonamides and their use as neuroprotective and/or neurorestorative agents 基因密码公司 2025-05-23 CN claimed
CN-119606059-A Preparation method of filter element material for enhancing tobacco smoke adsorption 奥伯风环境科技(南京)有限公司 2025-03-14 CN claimed
US-20230010299-A1 HETEROCYCLIC TRPML1 AGONISTS LIBRA THERAPEUTICS, INC. 2023-01-12 US claimed
EP-4058145-A1 HETEROCYCLIC TRPML1 AGONISTS Libra Therapeutics, Inc. (US) 2022-09-21 EP claimed
EP-2970119-B1 NOVEL INDOLE DERIVATIVES USEFUL AS ANTI-DIABETIC AGENTS MERCK SHARP & DOHME (US) 2021-11-03 EP claimed
US-11052082-B2 Combination of opioids and anticancer drugs for cancer treatment UNIVERSITÄT ULM (DE) 2021-07-06 US claimed
CN-112867706-A MASP-2 inhibitors and methods of use 奥默罗斯公司 2021-05-28 CN claimed
WO-2021094974-A1 HETEROCYCLIC TRPML1 AGONISTS LIBRA THERAPEUTICS, INC. (US) 2021-05-20 WO claimed
EP-3821947-A1 HETEROCYCLIC TRPML1 AGONISTS Libra Therapeutics, Inc. (US) 2021-05-19 EP claimed
EP-3802489-A2 MASP-2 INHIBITORS AND METHODS OF USE Omeros Corporation (US) 2021-04-14 EP claimed
CN-1859914-A Phenyl pyrrolidine ether tachykinin receptor antagonists MERCK & CO INC (US) 2006-11-08 CN claimed
WO-2006106052-A1 PYRAZOLES F. HOFFMANN-LA ROCHE AG (CH) 2006-10-12 WO claimed
US-20060223852-A1 Pyrazoles GILLESPIE PAUL 2006-10-05 US claimed
CN-1646499-A Fused pyridazine derivative compounds and drugs containing these compounds as active ingredients ONO PHARMACEUTICAL CO (JP) 2005-07-27 CN claimed
US-5545647-A PHOSPHODIESTERASE INHIBITORS; ANTIASTHMATICS MITSUBISHI CHEMICAL CORPORATION (JP) 1996-08-13 US claimed
EP-0671389-A1 3-Phenylpyrrolidine derivatives Mitsubishi Chemical Corporation (JP) 1995-09-13 EP claimed
EP-0431856-B1 Heterocyclic compounds ZENECA LTD (GB) 1995-07-12 EP claimed
EP-0309913-B1 Fungicidal N-substituted 3-aryl-pyrrolidine derivatives BASF AG (DE) 1994-06-15 EP claimed
US-4925901-A STORAGE STAABILITY, ONIUM ION CATALYST THE DOW CHEMICAL COMPANY (US) 1990-05-15 US claimed
EP-0309913-A2 Fungicidal N-substituted 3-aryl-pyrrolidine derivatives BASF Aktiengesellschaft (DE) 1989-04-05 EP 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 (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-20060223852-A1 Pyrazoles GPR119, PDK2, PC SLC18A3 3832/4885SIGMAR1 2649/4885HTR3A 1178/4885
US-11052082-B2 Combination of opioids and anticancer drugs for cancer treatment OPRM1, OPRL1, OPRK1 SLC18A3 382/4885SIGMAR1 7/4885HTR3A 72/4885
US-20230010299-A1 HETEROCYCLIC TRPML1 AGONISTS TRPM7, TRPM2, TRPM5 SLC18A3 477/4885SIGMAR1 1483/4885HTR3A 990/4885

“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.