SCHEMBL5101972

SCHEMBL5101972

CCC(N)c1cccc(Cl)c1

nearest known ligand 0.50

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 10/20 0.50
OPRD1 P41143 10/20 0.50
OPRK1 P41145 10/20 0.50
OPRL1 P41146 10/20 0.50
PNMT P11086 1/20 0.48
GBA1 P04062 1/20 0.47
AOC3 Q16853 1/20 0.46
SLC6A4 P31645 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
SCHEMBL1974847 1.00 OPRM1 (0.50) OPRM1OPRD1OPRK1OPRL1PNMT
SCHEMBL8037342 1.00 OPRM1 (0.50) OPRM1OPRD1OPRK1OPRL1PNMT
Hydrochloric Acid SCHEMBL23527440 0.98 OPRM1 (0.49) OPRM1OPRD1OPRK1OPRL1PNMT
Hydrochloric Acid SCHEMBL4535082 0.98 OPRM1 (0.49) OPRM1OPRD1OPRK1OPRL1PNMT
Hydrochloric Acid SCHEMBL23527439 0.98 OPRM1 (0.49) OPRM1OPRD1OPRK1OPRL1PNMT
SCHEMBL5712566 0.85 SLC6A4 (0.48) SLC6A4
SCHEMBL5652929 0.85 OPRM1 (0.49) OPRM1OPRD1OPRK1OPRL1PNMT
SCHEMBL16692504 0.85 OPRM1 (0.49) OPRM1OPRD1OPRK1OPRL1PNMT
SCHEMBL3489363 0.82 GBA1 (0.48) OPRM1OPRD1OPRK1OPRL1PNMT
SCHEMBL3446697 0.82 GBA1 (0.48) OPRM1OPRD1OPRK1OPRL1PNMT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9458463-B2 Method for treatment of diabetes by a small molecule inhibitor for GRK5 MAX-PLANCK-Gesellschaft zur Förderung der Wissenschaften e.V. (DE) 2016-10-04 US claimed
WO-2015022437-A1 INDOLINONE DERIVATIVES AS GRK5 MODULATORS MAX-PLANCK-Gesellschaft zur Förderung der Wissenschaften e.V. (DE) 2015-02-19 WO claimed
CN-118119600-A SOS1 inhibitors and uses thereof 治纳辅医药科技有限公司 2024-05-31 CN disclosed
EP-3215510-B1 SUBSTITUTED IMIDAZO[1,5-A]PYRIMIDINES AND THEIR USE IN THE TREATMENT OF MEDICAL DISORDERS BIAL R&D INVEST S A (PT) 2023-06-07 EP disclosed
US-11400095-B2 Substituted imidazo[1,5-a]pyrimidines and their use in the treatment of medical disorders Bial—R&D Investments, S.A. (PT) 2022-08-02 US disclosed
US-20210169886-A1 SUBSTITUTED IMIDAZO[1,5-A]PYRIMIDINES AND THEIR USE IN THE TREATMENT OF MEDICAL DISORDERS BIAL - R&D INVESTMENTS, S.A. (PT) 2021-06-10 US disclosed
US-10786508-B2 Substituted imidazo[1,5-A]-pyrimidines and their use in the treatment of medical disorders LYSOSOMAL THERAPEUTICS INC. (US) 2020-09-29 US disclosed
WO-2019156929-A1 THERAPEUTIC COMPOUNDS AND COMPOSITIONS eXIthera Pharmaceuticals Inc. (US) 2019-08-15 WO disclosed
US-20190216813-A1 SUBSTITUTED IMIDAZO[1,5-A]PYRIMIDINES AND THEIR USE IN THE TREATMENT OF MEDICAL DISORDERS BIAL - R&D INVESTMENTS, S.A. (PT) 2019-07-18 US disclosed
US-20170333435-A1 SUBSTITUTED IMIDAZO[1,5-A]PYRIMIDINES AND THEIR USE IN THE TREATMENT OF MEDICAL DISORDERS BIAL - BIOTECH INVESTMENTS, INC. (PT) 2017-11-23 US disclosed
EP-3215510-A1 SUBSTITUTED IMIDAZO[1,5-A]PYRIMIDINES AND THEIR USE IN THE TREATMENT OF MEDICAL DISORDERS Lysosomal Therapeutics Inc. (US) 2017-09-13 EP disclosed
EP-1818325-A2 3,4-DI-substituted cyclobutene-1,2-diones as CXC-chemokine receptor ligands SCHERING CORPORATION (US) 2007-08-15 EP disclosed
US-20070021494-A1 3,4-Di-substituted cyclobutene-1,2-diones as CXC-chemokine receptor ligands SCHERING CORPORATION AND PHARMACOPEIA, INC. 2007-01-25 US disclosed
US-20070021494-A1 3,4-Di-substituted cyclobutene-1,2-diones as CXC-chemokine receptor ligands SCHERING CORPORATION AND PHARMACOPEIA, INC. 2007-01-25 US disclosed
CN-1039997-C Cyanoquanidines as k-channel blockers PHAMACIA AND UPJOHN CO (US) 1998-09-30 CN disclosed
EP-0655057-B1 CYANOGUANIDINES AS POTASSIUM CHANNEL BLOCKERS UPJOHN CO (US) 1997-09-17 EP disclosed
US-5567722-A DIURETICS THE UPJOHN COMPANY (US) 1996-10-22 US disclosed
EP-0600507-B1 3-Azabicyclo(3.1.0.)hexane-2-one derivatives and Herbicidal Compositions Containing them as Herbicidally Active Ingredients MITSUI TOATSU CHEMICALS (JP) 1996-03-06 EP disclosed
CN-1090575-A K-channel blocker dicyanodiamide class UPJOHN CO (US) 1994-08-10 CN disclosed
WO-1994004500-A1 CYANOGUANIDINES AS POTASSIUM CHANNEL BLOCKERS THE UPJOHN COMPANY (US) 1994-03-03 WO 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 (6 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-20170333435-A1 SUBSTITUTED IMIDAZO[1,5-A]PYRIMIDINES AND THEIR USE IN THE TREATMENT OF MEDICAL DISORDERS GAA, GBA1, PARK7 OPRM1 872/4885OPRD1 1216/4885OPRK1 806/4885
US-20070021494-A1 3,4-Di-substituted cyclobutene-1,2-diones as CXC-chemokine receptor ligands CCR1, ACKR3, CXCR1 OPRM1 470/4885OPRD1 307/4885OPRK1 184/4885
US-20190216813-A1 SUBSTITUTED IMIDAZO[1,5-A]PYRIMIDINES AND THEIR USE IN THE TREATMENT OF MEDICAL DISORDERS GBA1, GAA, SNCA OPRM1 805/4885OPRD1 1063/4885OPRK1 726/4885
US-20210169886-A1 SUBSTITUTED IMIDAZO[1,5-A]PYRIMIDINES AND THEIR USE IN THE TREATMENT OF MEDICAL DISORDERS GBA1, GAA, SNCA OPRM1 805/4885OPRD1 1063/4885OPRK1 726/4885
US-11400095-B2 Substituted imidazo[1,5-a]pyrimidines and their use in the treatment of medical disorders GBA1, GAA, SNCA OPRM1 805/4885OPRD1 1063/4885OPRK1 726/4885
US-10786508-B2 Substituted imidazo[1,5-A]-pyrimidines and their use in the treatment of medical disorders GBA1, GAA, SNCA OPRM1 871/4885OPRD1 1278/4885OPRK1 836/4885

“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.