SCHEMBL4390692

SCHEMBL4390692

CC1CC(c2ccccc2)(c2ccccc2)CN1

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 1/20 0.42
OPRM1 P35372 2/20 0.41
CHRNB2 P17787 1/20 0.38
SLC6A2 P23975 1/20 0.38
CHRNB4 P30926 1/20 0.38
CHRNA3 P32297 1/20 0.38
CHRNA4 P43681 1/20 0.38
SLC6A3 Q01959 1/20 0.38
MAOB P27338 5/20 0.36
MAOA P21397 3/20 0.36
DRD4 P21917 1/20 0.36
MEN1 O00255 1/20 0.35
CYP2C9 P11712 1/20 0.35
KMT2A Q03164 1/20 0.35

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
SCHEMBL4391087 0.81 HTR2A (0.48) HTR2AOPRM1DRD4MEN1CYP2C9
SCHEMBL3552547 0.77 SLC6A2 (0.42) OPRM1CHRNB2SLC6A2CHRNB4CHRNA3
SCHEMBL16212879 0.76 CYP2D6 (0.40) HTR2AOPRM1MAOBMAOADRD4
Hydrochloric Acid SCHEMBL7844207 0.74 OPRM1 (0.48) HTR2AOPRM1MAOBMAOA
SCHEMBL23126472 0.70 LMNA (0.34) CHRNB2SLC6A2CHRNB4CHRNA3CHRNA4
SCHEMBL27498994 0.68 MAOB (0.55) OPRM1SLC6A2SLC6A3MAOBMAOA
SCHEMBL18703580 0.68 OPRM1 (0.43) OPRM1CHRNB2SLC6A2CHRNB4CHRNA3
Hydrochloric Acid SCHEMBL18689560 0.67 OPRM1 (0.42) OPRM1CHRNB2SLC6A2CHRNB4CHRNA3
SCHEMBL24481549 0.66 HTR2A (0.67) HTR2AOPRM1SLC6A2DRD4MEN1
SCHEMBL11019671 0.65 CHRNB2 (0.39) OPRM1CHRNB2SLC6A2CHRNB4CHRNA3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10953393-B2 Stabilization of active metal catalysts at metal-organic framework nodes for highly efficient organic transformations THE UNIVERSITY OF CHICAGO (US) 2021-03-23 US disclosed
US-10953393-B2 Stabilization of active metal catalysts at metal-organic framework nodes for highly efficient organic transformations THE UNIVERSITY OF CHICAGO (US) 2021-03-23 US disclosed
US-20180361370-A1 STABILIZATION OF ACTIVE METAL CATALYSTS AT METAL-ORGANIC FRAMEWORK NODES FOR HIGHLY EFFICIENT ORGANIC TRANSFORMATIONS NATIONAL SCIENCE FOUNDATION 2018-12-20 US disclosed
US-20120190854-A1 Hydroamination of Alkenes THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2012-07-26 US disclosed
US-20120190854-A1 Hydroamination of Alkenes THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2012-07-26 US disclosed
US-20120190854-A1 Hydroamination of Alkenes THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2012-07-26 US disclosed
US-8188302-B2 Hydroamination of alkenes THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2012-05-29 US disclosed
US-8188302-B2 Hydroamination of alkenes THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2012-05-29 US disclosed
US-8188302-B2 Hydroamination of alkenes THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2012-05-29 US disclosed
EP-2227479-B1 CYCLOPENTADIENYLPHOSPHAZENE COMPLEXES (CpPN COMPLEXES) OF METALS OF THE THIRD AND FOURTH GROUP AND OF THE LANTHANOIDS UNIV MARBURG PHILIPPS (DE) 2012-05-02 EP disclosed
EP-2227477-B1 ORTHO-METALATED, CHELATE-STABILIZED BENZYLAMINES OF THE RARE EARTH METALS (RE) UNIV MARBURG PHILIPPS (DE) 2011-09-28 EP disclosed
US-20110034713-A1 Ortho-metalated, chelate-stabilized benzylamines of the rare-earth metals (RE) Ar3RE PHILIPPS-UNIVERSITAT MARBURG (DE) 2011-02-10 US disclosed
US-20110034715-A1 Cyclopentadienylphosphazene complexes (CpPN Complexes) of metals of the third and fourth group and of the lanthanoids PHILIPPS-UNIVERSITAT MARBURG (DE) 2011-02-10 US disclosed
US-20090156824-A1 Hydroamination of Alkenes BOARD OF TRUSTEES OF UNIVERSITY OF ILLINOIS (US) 2009-06-18 US disclosed
US-20090156824-A1 Hydroamination of Alkenes BOARD OF TRUSTEES OF UNIVERSITY OF ILLINOIS (US) 2009-06-18 US disclosed
US-20090156824-A1 Hydroamination of Alkenes BOARD OF TRUSTEES OF UNIVERSITY OF ILLINOIS (US) 2009-06-18 US disclosed
WO-2009068000-A2 CYCLOPENTADIENYLPHOSPHAZENE COMPLEXES (CpPN COMPLEXES) OF METALS OF THE THIRD AND FOURTH GROUP AND OF THE LANTHANOIDS PHILIPPS-UNIVERSITÄT MARBURG (DE) 2009-06-04 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-20090156824-A1 Hydroamination of Alkenes HRH3, HRH4, H1-3 HTR2A 2025/4885OPRM1 465/4885CHRNB2 1298/4885
US-20110034715-A1 Cyclopentadienylphosphazene complexes (CpPN Complexes) of metals of the third and fourth group and of the lanthanoids CPNE4, CPN1, NCLN HTR2A 3670/4885OPRM1 3533/4885CHRNB2 591/4885
US-20110034713-A1 Ortho-metalated, chelate-stabilized benzylamines of the rare-earth metals (RE) Ar3RE AR, BAG3, MAPRE2 HTR2A 1544/4885OPRM1 40/4885CHRNB2 2811/4885
US-10953393-B2 Stabilization of active metal catalysts at metal-organic framework nodes for highly efficient organic transformations SBK1, SIK1, SIK2 HTR2A 743/4885OPRM1 1545/4885CHRNB2 3598/4885
US-20180361370-A1 STABILIZATION OF ACTIVE METAL CATALYSTS AT METAL-ORGANIC FRAMEWORK NODES FOR HIGHLY EFFICIENT ORGANIC TRANSFORMATIONS SBK1, SIK1, SIK2 HTR2A 743/4885OPRM1 1545/4885CHRNB2 3598/4885
US-20120190854-A1 Hydroamination of Alkenes HRH3, HRH4, H1-3 HTR2A 2025/4885OPRM1 465/4885CHRNB2 1298/4885

“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.