SCHEMBL20160460

SCHEMBL20160460

CCCOc1ccc(C(=O)N2C3CC2CN(SS)C3)cn1

nearest known ligand 0.47

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
RET P07949 8/20 0.47
MAPT P10636 1/20 0.38
ACACB O00763 4/20 0.38
RAB9A P51151 1/20 0.34

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
SCHEMBL23126207 0.88 RET (0.51) RETMAPTACACB
SCHEMBL20069572 0.86 RET (0.52) RETMAPTACACB
SCHEMBL20349517 0.86 NNMT (0.45) RET
SCHEMBL20148705 0.83 RET (0.48) RETMAPTACACB
SCHEMBL23555021 0.77 RET (0.51) RETMAPT
SCHEMBL20070454 0.76 RET (0.52) RETMAPT
SCHEMBL20962682 0.74 RET (0.44) RET
SCHEMBL20148702 0.74 RET (0.48) RETACACB
SCHEMBL20160459 0.74 RET (0.48) RETMAPT
SCHEMBL20962681 0.74 NNMT (0.46) RETMAPT

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 1/4885MAPT 1769/4885ACACB 4830/4885

“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.