SCHEMBL20160459

SCHEMBL20160459

COCCOc1ccc(C(=O)N2C3CC2CN(C(C)(C)C)C3)cn1

nearest known ligand 0.48

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
RET P07949 10/20 0.48
SCN9A Q15858 1/20 0.36
MAPT P10636 1/20 0.35
ADRA1A P35348 2/20 0.35
TACR3 P29371 1/20 0.35
GPR183 P32249 1/20 0.35
GABRA5 P31644 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
SCHEMBL20070454 0.88 RET (0.52) RETMAPTADRA1ATACR3GPR183
SCHEMBL23555021 0.86 RET (0.51) RETMAPTADRA1ATACR3GPR183
SCHEMBL20148702 0.85 RET (0.48) RET
SCHEMBL20152350 0.79 RET (0.47) RETTACR3GPR183
SCHEMBL20069572 0.77 RET (0.52) RETSCN9AMAPT
SCHEMBL23126207 0.76 RET (0.51) RETMAPT
SCHEMBL20148705 0.75 RET (0.48) RETMAPT
SCHEMBL18713231 0.74 NNMT (0.49) RETTACR3GPR183
SCHEMBL20160460 0.74 RET (0.47) RETMAPT
SCHEMBL20962681 0.74 NNMT (0.46) RETMAPTTACR3GPR183

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-20180134702-A1 SUBSTITUTED PYRAZOLO[1,5-A]PYRIDINE COMPOUNDS AS RET KINASE INHIBITORS ARRAY BIOPHARMA INC. 2018-05-17 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-20180134702-A1 SUBSTITUTED PYRAZOLO[1,5-A]PYRIDINE COMPOUNDS AS RET KINASE INHIBITORS RET, ROR1, BRAF RET 1/4885SCN9A 3108/4885MAPT 1769/4885

“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.