SCHEMBL20147340

SCHEMBL20147340

CC(C)N1CCC(C)(NC(=O)CC2CNC2)CC1

nearest known ligand 0.34

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 3/20 0.34
SMYD3 Q9H7B4 1/20 0.31
SIGMAR1 Q99720 1/20 0.30

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
SCHEMBL20069438 0.89 EPHX1 (0.33) EPHX1SMYD3
SCHEMBL20069718 0.87 EPHX1 (0.39) EPHX1SMYD3SIGMAR1
SCHEMBL20147339 0.79 WNT1 (0.37) SMYD3
SCHEMBL20147475 0.77 CCR1 (0.34) SIGMAR1
SCHEMBL20147467 0.76 TP53 (0.38) SIGMAR1
SCHEMBL20147307 0.75 SIGMAR1 (0.32) SIGMAR1
SCHEMBL20147372 0.74 HRH3 (0.34) SIGMAR1
SCHEMBL20147471 0.74 SIGMAR1 (0.37) SIGMAR1
SCHEMBL20158529 0.73 RET (0.50)
SCHEMBL20147473 0.72 SIGMAR1 (0.33) SIGMAR1

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-20180133207-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-20180133207-A1 SUBSTITUTED PYRAZOLO[1,5-A]PYRIDINE COMPOUNDS AS RET KINASE INHIBITORS RET, BRAF, RAF1 EPHX1 1481/4885SMYD3 1177/4885SIGMAR1 3807/4885

“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.