SCHEMBL3139830

SCHEMBL3139830

CCN1CCC(n2ccc3ccccc32)CC1

nearest known ligand 0.78

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 3/20 0.78
SLC6A4 P31645 2/20 0.78
OPRM1 P35372 1/20 0.57
OPRD1 P41143 1/20 0.57
OPRK1 P41145 1/20 0.57
OPRL1 P41146 1/20 0.57
HTR2A P28223 4/20 0.51
HTR7 P34969 3/20 0.51
SCD O00767 3/20 0.47
PRKCG P05129 1/20 0.44
PRKCB P05771 1/20 0.44
SRC P12931 1/20 0.44
PRKCA P17252 1/20 0.44
PRKCH P24723 1/20 0.44
PRKCE Q02156 1/20 0.44
PRKCZ Q05513 1/20 0.44
PRKCD Q05655 1/20 0.44
CAMK2B Q13554 1/20 0.44
CAMK2G Q13555 1/20 0.44
CAMK2D Q13557 1/20 0.44

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
SCHEMBL3150796 0.83 DRD2 (0.68) DRD2SLC6A4OPRM1OPRD1OPRK1
SCHEMBL30102638 0.82 DRD2 (0.70) DRD2SLC6A4OPRM1OPRD1OPRK1
SCHEMBL3144674 0.82 DRD2 (0.70) DRD2SLC6A4OPRM1OPRD1OPRK1
SCHEMBL7141854 0.82 DRD2 (0.74) DRD2SLC6A4OPRM1OPRD1OPRK1
SCHEMBL3144999 0.82 DRD2 (0.66) DRD2SLC6A4OPRM1OPRD1OPRK1
SCHEMBL28189418 0.81 DRD2 (0.65) DRD2SLC6A4OPRM1OPRD1OPRK1
SCHEMBL367111 0.81 DRD2 (0.63) DRD2SLC6A4OPRM1OPRD1OPRK1
SCHEMBL29423860 0.81 DRD2 (0.63) DRD2SLC6A4OPRM1OPRD1OPRK1
SCHEMBL3141317 0.81 DRD2 (0.64) DRD2SLC6A4OPRM1OPRD1OPRK1
Fluorobenzene SCHEMBL27494806 0.80 DRD2 (0.53) DRD2SLC6A4HTR2AHTR7SCD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170333426-A1 1,2,4-Triazolo [4,3-A] Pyridine Derivatives And Their Use For The Treatment Of Prevention Of Neurological And Psychiatric Disorders JANSSEN PHARMACEUTICALS INC (US) 2017-11-23 US disclosed
US-20170333426-A1 1,2,4-Triazolo [4,3-A] Pyridine Derivatives And Their Use For The Treatment Of Prevention Of Neurological And Psychiatric Disorders JANSSEN PHARMACEUTICALS INC (US) 2017-11-23 US disclosed
US-9737533-B2 1,2,4-triazolo [4,3-A] pyridine derivatives and their use for the treatment of prevention of neurological and psychiatric disorders Janssen Pharmaceuticals. Inc. (US) 2017-08-22 US disclosed
US-9737533-B2 1,2,4-triazolo [4,3-A] pyridine derivatives and their use for the treatment of prevention of neurological and psychiatric disorders Janssen Pharmaceuticals. Inc. (US) 2017-08-22 US disclosed
US-20160067245-A1 1,2,4-Triazolo [4,3-A] Pyridine Derivatives and Their Use For The Treatment of Prevention of Neurological and Psychiatric Disorders JANSSEN PHARMACEUTICALS INC (US) 2016-03-10 US disclosed
US-20160067245-A1 1,2,4-Triazolo [4,3-A] Pyridine Derivatives and Their Use For The Treatment of Prevention of Neurological and Psychiatric Disorders JANSSEN PHARMACEUTICALS INC (US) 2016-03-10 US disclosed
US-9226930-B2 1,2,4-triazolo [4,3-a] pyridine derivatives and their use for the treatment of prevention of neurological and psychiatric disorders Janssen Pharmaceuticals, Inc. (US) 2016-01-05 US disclosed
US-9226930-B2 1,2,4-triazolo [4,3-a] pyridine derivatives and their use for the treatment of prevention of neurological and psychiatric disorders Janssen Pharmaceuticals, Inc. (US) 2016-01-05 US disclosed
US-20150141403-A1 1,2,4-Triazolo [4,3-A] Pyridine Derivatives and Their Use For The Treatment of Prevention of Neurological and Psychiatric Disorders JANSSEN PHARMACEUTICALS INC (US) 2015-05-21 US disclosed
US-20150141403-A1 1,2,4-Triazolo [4,3-A] Pyridine Derivatives and Their Use For The Treatment of Prevention of Neurological and Psychiatric Disorders JANSSEN PHARMACEUTICALS INC (US) 2015-05-21 US disclosed
EP-1449529-B1 Protein Kinase C Inhibitors LILLY CO ELI (US) 2010-01-27 EP disclosed
WO-2007137590-A1 SERTINDOLE FOR THE PREVENTIVE TREATMENT OF SUICIDAL BEHAVIOUR H. LUNDBECK A/S (DK) 2007-12-06 WO disclosed
EP-0817627-B1 PROTEIN KINASE C INHIBITORS LILLY CO ELI (US) 2005-03-09 EP disclosed
EP-1449529-A1 Protein Kinase C Inhibitors ELI LILLY AND COMPANY (US) 2004-08-25 EP disclosed
EP-0817627-A1 PROTEIN KINASE C INHIBITORS ELI LILLY AND COMPANY (US) 1998-01-14 EP disclosed
US-5672618-A TREATING DIABETIC COMPLICATIONS ELI LILLY AND COMPANY (US) 1997-09-30 US disclosed
US-5668152-A BIS/INDOLE/-SUBSTITUTED MALEIMIDES, ANTIDIABETIC AGENTS ELI LILLY AND COMPANY (US) 1997-09-16 US disclosed
US-5661173-A ADMINISTERING AN ENZYME INHIBITOR TREATING DIABETES ELI LILLY AND COMPANY (US) 1997-08-26 US disclosed
US-5545636-A TREATING DIABETES MELLITUS ELI LILLY AND COMPANY (US) 1996-08-13 US disclosed
WO-1995017182-A1 PROTEIN KINASE C INHIBITORS ELI LILLY AND COMPANY (US) 1995-06-29 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 (3 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-20170333426-A1 1,2,4-Triazolo [4,3-A] Pyridine Derivatives And Their Use For The Treatment Of Prevention Of Neurological And Psychiatric Disorders GRM2, GRM1, GRIN2C DRD2 202/4885SLC6A4 198/4885OPRM1 251/4885
US-20160067245-A1 1,2,4-Triazolo [4,3-A] Pyridine Derivatives and Their Use For The Treatment of Prevention of Neurological and Psychiatric Disorders GRM2, GRM1, GRIN2C DRD2 202/4885SLC6A4 198/4885OPRM1 251/4885
US-20150141403-A1 1,2,4-Triazolo [4,3-A] Pyridine Derivatives and Their Use For The Treatment of Prevention of Neurological and Psychiatric Disorders GRM2, GRM1, GRIN2C DRD2 147/4885SLC6A4 208/4885OPRM1 269/4885

“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.