SCHEMBL6016876

SCHEMBL6016876

CCC(C(=O)N(C)C)(c1ccccc1)c1ccccc1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 14/20 0.67
DRD3 P35462 12/20 0.67
DRD4 P21917 6/20 0.67
DRD2 P14416 10/20 0.55
CHRM2 P08172 2/20 0.50
CHRM1 P11229 2/20 0.50
CHRM3 P20309 1/20 0.50
GRIN2D O15399 2/20 0.49
GRIN1 Q05586 2/20 0.49
GRIN2A Q12879 2/20 0.49
GRIN2B Q13224 2/20 0.49
GRIN2C Q14957 2/20 0.49
ABCB1 P08183 2/20 0.49
OPRD1 P41143 2/20 0.49
OPRK1 P41145 2/20 0.49
KCNH2 Q12809 2/20 0.49
CACNA1F O60840 1/20 0.49
CYP2B6 P20813 1/20 0.49
CACNA1D Q01668 1/20 0.49
CACNA1S Q13698 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 SCHEMBL27553852 0.98 OPRM1 (0.65) OPRM1DRD3DRD4DRD2CHRM2
SCHEMBL10440077 0.85 OPRM1 (0.73) OPRM1DRD3DRD4DRD2CHRM2
SCHEMBL6309263 0.83 OPRM1 (0.65) OPRM1DRD3DRD4DRD2CHRM2
SCHEMBL10884718 0.83 OPRM1 (0.65) OPRM1DRD3DRD4DRD2CHRM2
SCHEMBL6078982 0.83 CHRM2 (0.53) OPRM1DRD3DRD4DRD2CHRM2
SCHEMBL7173871 0.81 OPRM1 (0.73) OPRM1DRD3DRD4DRD2CHRM2
SCHEMBL24683657 0.80 OPRM1 (0.61) OPRM1DRD3DRD4DRD2CHRM2
SCHEMBL20245629 0.80 OPRM1 (0.71) OPRM1DRD3DRD4DRD2CHRM2
SCHEMBL5038143 0.80 OPRM1 (0.65) OPRM1DRD3DRD4DRD2CHRM2
SCHEMBL11752498 0.79 CHRM2 (0.51) OPRM1DRD3DRD4DRD2CHRM2

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 20 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2015184317-A1 PHARMACEUTICAL COMPOSITION WITH IONICALLY CROSSLINKED POLYMER ENCAPSULATION OF ACTIVE INGREDIENT ALLEN ERIC (US) 2015-12-03 WO claimed
US-20260027068-A1 METHODS OF ADMINISTERING R-KETAMINE PERCEPTION NEUROSCIENCE INC (US) 2026-01-29 US disclosed
EP-4313039-B1 BENZOMORPHAN DERIVATE FOR USE IN THERAPY MOLECULAR RES PHARMACT S R L (IT) 2025-09-03 EP disclosed
US-20240197699-A1 BENZOMORPHAN DERIVATE FOR USE IN THERAPY MOLECULAR RESEARCH PHARMACT S.R.L. (IT) 2024-06-20 US disclosed
EP-4313039-A1 BENZOMORPHAN DERIVATE FOR USE IN THERAPY Molecular Research Pharmact S.r.l. (IT) 2024-02-07 EP disclosed
WO-2022208375-A1 BENZOMORPHAN DERIVATE FOR USE IN THERAPY MOLECULAR RESEARCH PHARMACT S.R.L. (IT) 2022-10-06 WO disclosed
WO-2022187206-A1 DUAL-TARGET MU OPIOID AND DOPAMINE D3 RECEPTORS LIGANDS; PREPARATION AND USE THEREOF THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2022-09-09 WO disclosed
US-11426367-B2 Methods of treating substance abuse PERCEPTION NEUROSCIENCE, INC. (US) 2022-08-30 US disclosed
WO-2015184317-A1 PHARMACEUTICAL COMPOSITION WITH IONICALLY CROSSLINKED POLYMER ENCAPSULATION OF ACTIVE INGREDIENT ALLEN ERIC (US) 2015-12-03 WO disclosed
WO-2014178065-A1 COMPOSITIONS OF PHARMACEUTICAL ACTIVES CONTAINING DIETHYLENE GLYCOL MONOETHYL ETHER OR OTHER ALKYL DERIVATIVES THEMIS MEDICARE LIMITED (IN) 2014-11-06 WO disclosed
US-8716657-B2 High sensitivity mass spectrometry systems ILLINOIS STATE UNIVERSITY (US) 2014-05-06 US disclosed
US-20140042313-A1 HIGH SENSITIVITY MASS SPECTROMETRY SYSTEMS ILLINOIS STATE UNIVERSITY (US) 2014-02-13 US disclosed
US-8592754-B2 High sensitivity mass spectrometry systems ILLINOIS STATE UNIVERSITY (US) 2013-11-26 US disclosed
WO-2012155090-A2 HIGH SENSITIVITY MASS SPECTROMETRY SYSTEMS ILLINOIS STATE UNIVERSITY (US) 2012-11-15 WO disclosed
US-20120286155-A1 High Sensitivity Mass Spectrometry Systems ILLINOIS STATE UNIVERSITY (US) 2012-11-15 US disclosed
EP-1709029-A2 METHODS FOR MAKING 4-TETRAZOLYL-4-PHENYLPIPERIDINE COMPOUNDS EURO-CELTIQUE S.A. (LU) 2006-10-11 EP disclosed
US-20060094716-A1 1-Pyridin-4-yl-urea derivatives ACTELION PHARMACEUTICALS LTD (CH) 2006-05-04 US disclosed
WO-2005075455-A2 METHODS FOR MAKING 4-TETRAZOLYL-4-PHENYLPIPERIDINE COMPOUNDS EURO-CELTIQUE S.A. (LU) 2005-08-18 WO disclosed
CN-1469862-A 2, 2-diphenylbutanamide derivatives and drugs containing the same SS制药株式会社 2004-01-21 CN disclosed
CN-1304929-A 4-hydroxy-4-phenyl piperidine derivative and medicine containing said derivative SS PHARMACEUTICAL CO (JP) 2001-07-25 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 (4 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-20240197699-A1 BENZOMORPHAN DERIVATE FOR USE IN THERAPY FABP4, ADIPOR1, GPR119 OPRM1 6/4885DRD3 933/4885DRD4 456/4885
US-11426367-B2 Methods of treating substance abuse OPRK1, TACR2, SLC6A3 OPRM1 12/4885DRD3 38/4885DRD4 60/4885
US-20060094716-A1 1-Pyridin-4-yl-urea derivatives P2RY4, P2RX4, REN OPRM1 72/4885DRD3 369/4885DRD4 290/4885
US-20260027068-A1 METHODS OF ADMINISTERING R-KETAMINE SNCA, OPRD1, OPRK1 OPRM1 22/4885DRD3 21/4885DRD4 24/4885

“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.