SCHEMBL4255190

SCHEMBL4255190

OC1CCN(CCc2ccccc2)CC1

nearest known ligand 0.69

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ACHE P22303 1/20 0.69
CCR3 P51677 1/20 0.67
SLC6A3 Q01959 1/20 0.63
HTR2A P28223 3/20 0.62
HTR2C P28335 2/20 0.62
SPHK1 Q9NYA1 1/20 0.62
KDM4E B2RXH2 1/20 0.62
CYP1A2 P05177 1/20 0.62
CYP3A4 P08684 1/20 0.62
CYP2D6 P10635 1/20 0.62
TSHR P16473 1/20 0.62
SIGMAR1 Q99720 2/20 0.61
KCNA3 P22001 1/20 0.60
KCNH2 Q12809 1/20 0.58
OPRM1 P35372 2/20 0.57
OPRD1 P41143 2/20 0.57
OPRK1 P41145 2/20 0.57
ADRA1A P35348 1/20 0.57
ADRA1B P35368 1/20 0.57

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
SCHEMBL10458165 0.89 SLC6A3 (0.70) ACHECCR3SLC6A3HTR2AHTR2C
SCHEMBL7983946 0.89 SIGMAR1 (0.70) CCR3HTR2ASPHK1CYP1A2CYP3A4
SCHEMBL5537485 0.89 ACHE (0.60) ACHECCR3SLC6A3HTR2AHTR2C
SCHEMBL5534146 0.89 ACHE (0.60) ACHECCR3SLC6A3HTR2AHTR2C
SCHEMBL6423692 0.89 ACHE (0.60) ACHECCR3SLC6A3HTR2AHTR2C
SCHEMBL10438853 0.88 SIGMAR1 (0.69) CCR3SPHK1CYP1A2CYP3A4CYP2D6
SCHEMBL3958257 0.84 HRH3 (0.58) ACHECCR3CYP1A2CYP3A4CYP2D6
SCHEMBL14100275 0.84 SPHK1 (0.65) ACHECCR3HTR2AHTR2CSPHK1
SCHEMBL4255182 0.83 ACHE (0.71) ACHECCR3SLC6A3HTR2AHTR2C
SCHEMBL24495209 0.82 SPHK1 (0.63) ACHECCR3HTR2AHTR2CSPHK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0385044-A1 New piperidine derivatives as antihistaminics FABRICA ESPANOLA DE PRODUCTOS QUIMICOS Y FARMACEUTICOS, S.A. (FAES) (ES) 1990-09-05 EP claimed
EP-3597670-B1 WATER-SOLUBLE COMPOSITION, PRODUCTION METHOD FOR CURED PRODUCT THEREOF, AND CURED PRODUCT THEREOF, AND ACYL PHOSPHINATE ADEKA CORP (JP) 2024-07-10 EP disclosed
US-20230349869-A1 METHODS AND SYSTEMS FOR OPIOID DETECTION NAT TECH & ENG SOLUTIONS SANDIA LLC (US) 2023-11-02 US disclosed
US-11733217-B1 Methods and systems for opioid detection NATIONAL TECHNOLOGY & ENGINEERING SOLUTIONS OF SANDIA, LLC (US) 2023-08-22 US disclosed
US-11649334-B2 Water-soluble composition, production method for cured product thereof, and cured product thereof, and acyl phosphinate ADEKA CORPORATION (JP) 2023-05-16 US disclosed
WO-2021106678-A1 ACYLPHOSPHINE COMPOSITION, POLYMERIZATION INITIATOR, POLYMERIZABLE COMPOSITION, CURED PRODUCT, AND METHOD FOR PRODUCING CURED PRODUCT 株式会社ADEKA 2021-06-03 WO disclosed
WO-2021095711-A1 POLYMERIZABLE COMPOSITION, VEHICLE, AND CURED OBJECT AND PRODUCTION METHOD THEREFOR 株式会社ADEKA 2021-05-20 WO disclosed
US-20210107887-A1 RADICAL POLYMERIZATION INITIATOR, COMPOSITION CONTAINING SAME, CURED PRODUCT OF COMPOSITION, PRODUCTION METHOD FOR CURED PRODUCT, AND COMPOUND ADEKA CORPORATION (JP) 2021-04-15 US disclosed
EP-3753958-A1 RADICAL POLYMERIZATION INITIATOR, COMPOSITION CONTAINING SAME, CURED PRODUCT OF COMPOSITION, PRODUCTION METHOD FOR CURED PRODUCT, AND COMPOUND ADEKA CORPORATION (JP) 2020-12-23 EP disclosed
US-20200032021-A1 WATER-SOLUBLE COMPOSITION, PRODUCTION METHOD FOR CURED PRODUCT THEREOF, AND CURED PRODUCT THEREOF, AND ACYL PHOSPHINATE ADEKA CORPORATION (JP) 2020-01-30 US disclosed
EP-0063365-B2 1,4-Dihydropyridine derivative and pharmaceutical composition containing same KYOWA HAKKO KOGYO KK (JP) 1994-06-15 EP disclosed
EP-0149088-B1 PYRIDINE-2-ETHERS RESPECTIVELY PYRIDINE-2-THIOETHERS WITH A NITROGEN CONTAINING CYCLOALIPHATIC RING AND SULFOXIDES,SULFANES AND PYRIDIN-N-OXIDES THEREOF ASTA Pharma Aktiengesellschaft (DE) 1989-01-18 EP disclosed
US-4643995-A Analgesic pyridine-2-ethers or pyridine-2-thioethers having a nitrogen-containing cycloaliphatic ring DEGUSSA AKTIENGESELLSCHAFT (DE) 1987-02-17 US disclosed
EP-0079740-B1 ANTHRANILOYLOXYALKANOATES RECORDATI S.A. CHEMICAL and PHARMACEUTICAL COMPANY (CH) 1985-11-13 EP disclosed
EP-0063365-B1 1,4-DIHYDROPYRIDINE DERIVATIVE AND PHARMACEUTICAL COMPOSITION CONTAINING SAME KYOWA HAKKO KOGYO CO., LTD. (JP) 1985-09-04 EP disclosed
EP-0149088-A1 Pyridine-2-ethers respectively pyridine-2-thioethers with a nitrogen containing cycloaliphatic ring and sulfoxides,sulfanes and pyridin-N-oxides thereof ASTA Pharma Aktiengesellschaft (DE) 1985-07-24 EP disclosed
US-4482561-A ANALGESICS, ANTIINFLAMMATORY AGENT, ANTICOAGULANT, AND ANTIDEPRESSANT RECORDATI, S. A., CHEMICAL & PHARMACEUTICAL CO. (CH) 1984-11-13 US disclosed
US-4448964-A HYPOTENSIVE AGENTS; VASODILATORS KYOWA HAKKO KOGYO CO., LTD. (JP) 1984-05-15 US disclosed
EP-0079740-A1 Anthraniloyloxyalkanoates RECORDATI S.A. CHEMICAL and PHARMACEUTICAL COMPANY (CH) 1983-05-25 EP disclosed
EP-0063365-A1 1,4-Dihydropyridine derivative and pharmaceutical composition containing same KYOWA HAKKO KOGYO CO., LTD. (JP) 1982-10-27 EP 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-20200032021-A1 WATER-SOLUBLE COMPOSITION, PRODUCTION METHOD FOR CURED PRODUCT THEREOF, AND CURED PRODUCT THEREOF, AND ACYL PHOSPHINATE PHOSPHO1, ASS1, SGMS1 ACHE 1346/4885CCR3 4836/4885SLC6A3 4697/4885
US-11649334-B2 Water-soluble composition, production method for cured product thereof, and cured product thereof, and acyl phosphinate PHOSPHO1, ASS1, SGMS1 ACHE 1346/4885CCR3 4836/4885SLC6A3 4697/4885
US-20210107887-A1 RADICAL POLYMERIZATION INITIATOR, COMPOSITION CONTAINING SAME, CURED PRODUCT OF COMPOSITION, PRODUCTION METHOD FOR CURED PRODUCT, AND COMPOUND RRP12, ASH2L, RER1 ACHE 3014/4885CCR3 3055/4885SLC6A3 4819/4885

“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.