SCHEMBL385443

SCHEMBL385443

COc1cccc2c1CC(N)C2

nearest known ligand 0.75

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 3/20 0.73
DRD3 P35462 3/20 0.73
ADRA1A P35348 3/20 0.66
CHRM2 P08172 3/20 0.53
CHRM1 P11229 3/20 0.53
CHRM3 P20309 3/20 0.53
HTR1A P08908 3/20 0.53
DRD4 P21917 2/20 0.51
CYP19A1 P11511 1/20 0.50
HTR2A P28223 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
SCHEMBL31324598 1.00 DRD2 (0.73) DRD2DRD3ADRA1ACHRM2CHRM1
Hydrochloric Acid SCHEMBL1786250 0.98 DRD2 (0.71) DRD2DRD3ADRA1ACHRM2CHRM1
SCHEMBL8076233 0.86 DRD2 (0.79) DRD2DRD3ADRA1ACHRM2CHRM1
SCHEMBL266921 0.86 DRD2 (0.79) DRD2DRD3ADRA1ACHRM2CHRM1
SCHEMBL4210081 0.86 DRD2 (0.79) DRD2DRD3ADRA1ACHRM2CHRM1
SCHEMBL895845 0.84 DRD2 (1.00) DRD2DRD3ADRA1ACHRM2CHRM1
SCHEMBL43366 0.84 DRD2 (1.00) DRD2DRD3ADRA1ACHRM2CHRM1
Hydrochloric Acid SCHEMBL4208502 0.84 DRD2 (0.77) DRD2DRD3ADRA1ACHRM2CHRM1
Hydrochloric Acid SCHEMBL4213402 0.84 DRD2 (0.77) DRD2DRD3ADRA1ACHRM2CHRM1
SCHEMBL895742 0.84 DRD2 (1.00) DRD2DRD3ADRA1ACHRM2CHRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9884814-B2 Acylguanidines for treating osteoarthritis MERCK PATENT GMBH (DE) 2018-02-06 US claimed
US-20150361037-A1 ACYLGUANIDINES FOR TREATING OSTEOARTHRITIS MERCK PATENT GMBH (DE) 2015-12-17 US claimed
EP-4522596-A1 DIHYDROINDENE DERIVATIVES AS MALT1 INHIBITORS C4X Discovery Limited (GB) 2025-03-19 EP disclosed
WO-2023218203-A1 DIHYDROINDENE DERIVATIVES AS MALT1 INHIBITORS C4X DISCOVERY LIMITED (GB) 2023-11-16 WO disclosed
US-9884814-B2 Acylguanidines for treating osteoarthritis MERCK PATENT GMBH (DE) 2018-02-06 US disclosed
US-20150361037-A1 ACYLGUANIDINES FOR TREATING OSTEOARTHRITIS MERCK PATENT GMBH (DE) 2015-12-17 US disclosed
US-20140323487-A1 Novel Compounds As Antagonists Or Inverse Agonists At Opioid Receptors GLAXOSMITHKLINE LLC 2014-10-30 US disclosed
US-20140323487-A1 Novel Compounds As Antagonists Or Inverse Agonists At Opioid Receptors GLAXOSMITHKLINE LLC 2014-10-30 US disclosed
US-8822518-B2 Compounds as antagonists or inverse agonists of opioid receptors for treatment of addiction GLAXOSMITHKLINE LLC (US) 2014-09-02 US disclosed
US-8822518-B2 Compounds as antagonists or inverse agonists of opioid receptors for treatment of addiction GLAXOSMITHKLINE LLC (US) 2014-09-02 US disclosed
US-8633175-B2 Compounds as antagonists or inverse agonists at opioid receptors GLAXOSMITHKLINE LLC (US) 2014-01-21 US disclosed
EP-1018514-A1 NF-$g(k)B INHIBITORS CONTAINING INDAN DERIVATIVES AS THE ACTIVE INGREDIENT SUNTORY LIMITED (JP) 2000-07-12 EP disclosed
EP-0452390-B1 HALO SUBSTITUTED AMINOTETRALINS UPJOHN CO (US) 1994-10-26 EP disclosed
US-5225596-A Halo substituted aminotetralins THE UPJOHN COMPANY (US) 1993-07-06 US disclosed
EP-0334538-B1 THERAPEUTICALLY USEFUL TETRALIN DERIVATIVES THE UPJOHN COMPANY (US) 1992-12-02 EP disclosed
EP-0452390-A1 HALO SUBSTITUTED AMINOTETRALINS. UPJOHN CO (US) 1991-10-23 EP disclosed
EP-0407416-A1 THERAPEUTICALLY USEFUL TETRALIN DERIVATIVES THE UPJOHN COMPANY (US) 1991-01-16 EP disclosed
WO-1990007490-A1 HALO SUBSTITUTED AMINOTETRALINS THE UPJOHN COMPANY (US) 1990-07-12 WO disclosed
WO-1989009050-A1 THERAPEUTICALLY USEFUL TETRALIN DERIVATIVES THE UPJOHN COMPANY (US) 1989-10-05 WO disclosed
EP-0334538-A1 Therapeutically useful tetralin derivatives THE UPJOHN COMPANY (US) 1989-09-27 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 (2 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-20150361037-A1 ACYLGUANIDINES FOR TREATING OSTEOARTHRITIS CTSG, CTSD, CTSB DRD2 1315/4885DRD3 1897/4885ADRA1A 1697/4885
US-20140323487-A1 Novel Compounds As Antagonists Or Inverse Agonists At Opioid Receptors OPRL1, OPRM1, OPRK1 DRD2 178/4885DRD3 241/4885ADRA1A 18/4885

“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.