SCHEMBL216848

SCHEMBL216848

OC1(c2ccc(Cl)cc2)CC[N]CC1

nearest known ligand 0.60

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 3/20 0.60
CCR3 P51677 2/20 0.47
OPRL1 P41146 6/20 0.46
OPRM1 P35372 4/20 0.46
OPRD1 P41143 2/20 0.46
OPRK1 P41145 2/20 0.46
SLC18A3 Q16572 1/20 0.45
KMT2A Q03164 2/20 0.43
MEN1 O00255 1/20 0.43
ADRA1A P35348 1/20 0.41

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
SCHEMBL29090112 0.84 DRD2 (0.72) DRD2CCR3OPRL1OPRM1OPRD1
SCHEMBL16249345 0.80 DRD2 (0.67) DRD2CCR3OPRL1OPRM1OPRD1
SCHEMBL3126817 0.79 OPRM1 (0.46) DRD2OPRL1OPRM1OPRD1OPRK1
SCHEMBL3640272 0.79 OPRM1 (0.46) DRD2OPRL1OPRM1OPRD1OPRK1
SCHEMBL3876399 0.79 OPRM1 (0.50) DRD2OPRL1OPRM1OPRD1OPRK1
SCHEMBL8986023 0.78 DRD2 (0.64) DRD2CCR3OPRL1OPRM1OPRD1
SCHEMBL22870543 0.78 DRD2 (0.64) DRD2CCR3OPRL1OPRM1OPRD1
SCHEMBL42581 0.78 OPRL1 (0.52) OPRL1OPRM1OPRD1OPRK1
SCHEMBL11362121 0.77 OPRM1 (0.44) DRD2OPRL1OPRM1OPRD1OPRK1
SCHEMBL187716 0.75 DRD2 (1.00) DRD2CCR3OPRL1OPRM1OPRD1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8853392-B2 Benzamide mGluR5 positive allosteric modulators and methods of making and using same VANDERBILT UNIVERSITY (US) 2014-10-07 US claimed
WO-2010022055-A2 INHIBITORS OF VOLTAGE-GATED SODIUM CHANNELS AMGEN INC. (US) 2010-02-25 WO claimed
EP-1348706-B1 SUBSTITUTED THIAZOLE DERIVATIVES BEARING 3-PYRIDYL GROUPS, PROCESS FOR PREPARING THE SAME AND USE THEREOF TAKEDA PHARMACEUTICAL (JP) 2009-08-19 EP claimed
US-20070299105-A1 2-Cyanopropanoic Acid Amide and Ester Derivatives and Methods of Their Use WYETH (US) 2007-12-27 US claimed
US-20040072876-A1 Substituted thiazole derivatives bearing 3-pyridyl groups, process for preparing the same and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2004-04-15 US claimed
EP-1348706-A1 SUBSTITUTED THIAZOLE DERIVATIVES BEARING 3-PYRIDYL GROUPS, PROCESS FOR PREPARING THE SAME AND USE THEREOF Takeda Chemical Industries, Ltd. (JP) 2003-10-01 EP claimed
US-20010034444-A1 Certain bridged 4-phenyl-2-aminomethylimidazoles; new dopamine receptor subtype specific ligands NEUROGEN CORPORATION 2001-10-25 US claimed
US-5789410-A TREATMENT OF SCHIZOPHRENIA, DEPRESSION, PARKINSON'S DISEASE NEUROGEN CORPORATION (US) 1998-08-04 US claimed
US-5773616-A NEUROTROPSYCHOLOGICAL FOR SCHIZOPHRENIA AND ANTIDEPRESSANTS NEUROGEN CORPORATION (US) 1998-06-30 US claimed
US-4284638-A Pharmaceutical compositions with central depressant and antipsychotic activity having a butyrophenone derivative which is substituted in the 4-position and a C-(2-benzofuranyl)-piperidine or C-(2-benzofuranyl)-tetrahydro-pyridine CIBA-GEIGY CORPORATION (US) 1981-08-18 US claimed
EP-0011606-A2 Pharmaceutical compositions with central depressing and antipsychotic activity CIBA-GEIGY AG (CH) 1980-05-28 EP claimed
US-4022791-A ANALGESICS, TRANQUILIZERS PFIZER INC. (US) 1977-05-10 US claimed
US-11178872-B2 Cyclic amine compound and pest control agent NIPPON SODA CO., LTD. (JP) 2021-11-23 US disclosed
US-20190191702-A1 CYCLIC AMINE COMPOUND AND PEST CONTROL AGENT NIPPON SODA CO., LTD. (JP) 2019-06-27 US disclosed
EP-3456716-A1 RING-SHAPED AMINE COMPOUND AND PEST CONTROL AGENT NIPPON SODA CO., LTD. (JP) 2019-03-20 EP disclosed
US-8853392-B2 Benzamide mGluR5 positive allosteric modulators and methods of making and using same VANDERBILT UNIVERSITY (US) 2014-10-07 US disclosed
US-4061637-A CNS, CARDIOVASCULAR, ANTIINFLAMMATORY, ADRENOLYTIC, ANTIULCER ISTITUTO LUSO FARMACO D'ITALIA S.R.L. (IT) 1977-12-06 US disclosed
US-4046762-A CENTRAL NERVOUS SYSTEM INHIBITORS INSTITUTO LUSO FARMACO D'ITALIA S.R.L. (IT) 1977-09-06 US disclosed
US-3988475-A ANAESTHETICS, ANTIARRHYTHMIA, HYPOTENSIVES, ADRENERGIC ISTITUTO LUSO FARMACO D'ITALIA S.R.L. (IT) 1976-10-26 US disclosed
US-3951978-A ANALGESIC, ANTIARRHYTHMIC, CENTRAL NERVOUS DEPRESSANT ISTITUTO LUSO FARMACO D'ITALIA S.R.L. (IT) 1976-04-20 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 (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-20040072876-A1 Substituted thiazole derivatives bearing 3-pyridyl groups, process for preparing the same and use thereof CYP17A1, CYP21A2, HSD17B1 DRD2 4715/4885CCR3 1000/4885OPRL1 2228/4885
US-20070299105-A1 2-Cyanopropanoic Acid Amide and Ester Derivatives and Methods of Their Use HCAR2, PCCA, MCCC2 DRD2 4174/4885CCR3 312/4885OPRL1 4024/4885
US-20190191702-A1 CYCLIC AMINE COMPOUND AND PEST CONTROL AGENT H1-4, H1-10, NPR1 DRD2 717/4885CCR3 297/4885OPRL1 3008/4885
US-20010034444-A1 Certain bridged 4-phenyl-2-aminomethylimidazoles; new dopamine receptor subtype specific ligands DBH, XDH, DRD2 DRD2 3/4885CCR3 1365/4885OPRL1 30/4885
US-11178872-B2 Cyclic amine compound and pest control agent H1-4, H1-10, NPR1 DRD2 717/4885CCR3 297/4885OPRL1 3008/4885

“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.