SCHEMBL19625664

SCHEMBL19625664

COCC(=O)NNc1nccc(N2CCC(c3ccccc3)CC2)c1Cl

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 1/20 0.44
GRM2 Q14416 11/20 0.42
AOC3 Q16853 1/20 0.40
DRD2 P14416 5/20 0.40
DRD3 P35462 5/20 0.40
PRCP P42785 1/20 0.39
HTR1A P08908 1/20 0.38
DRD1 P21728 1/20 0.38
DRD4 P21917 1/20 0.38
HTR2A P28223 1/20 0.38
HTR2C P28335 1/20 0.38
HTR2B P41595 1/20 0.38
OGA O60502 1/20 0.38
HTT P42858 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38

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
SCHEMBL6928779 0.90 GRM2 (0.43) OPRM1GRM2AOC3DRD2DRD3
SCHEMBL6926573 0.87 GRM2 (0.48) OPRM1GRM2DRD2DRD3PRCP
SCHEMBL746720 0.76 DHFR (0.48) GRM2DRD2DRD3
SCHEMBL19262425 0.76 GRM2 (0.50) OPRM1GRM2
SCHEMBL10819327 0.76 GRM2 (0.41) OPRM1GRM2AOC3DRD2DRD3
SCHEMBL16755897 0.75 GRM2 (0.48) GRM2PRCP
SCHEMBL16755881 0.74 GRM2 (0.47) GRM2
SCHEMBL16755786 0.74 GRM2 (0.47) GRM2HTR2A
SCHEMBL16755834 0.73 GRM2 (0.48) GRM2PRCP
SCHEMBL16755929 0.73 GRM2 (0.48) GRM2PRCP

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 1 patent. 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

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 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 OPRM1 251/4885GRM2 1/4885AOC3 2052/4885

“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.