SCHEMBL20147864

SCHEMBL20147864

CC(S)N1CCC(O)(Cc2ccc(F)cc2)CC1

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 2/20 0.48
OPRD1 P41143 2/20 0.48
OPRK1 P41145 2/20 0.48
OPRL1 P41146 2/20 0.48
SSTR5 P35346 1/20 0.40
GRIN2B Q13224 7/20 0.40
GRIN2D O15399 6/20 0.40
GRIN3B O60391 6/20 0.40
ADRA1A P35348 6/20 0.40
GRIN1 Q05586 6/20 0.40
GRIN2A Q12879 6/20 0.40
GRIN2C Q14957 6/20 0.40
GRIN3A Q8TCU5 6/20 0.40
ADRA1D P25100 4/20 0.40
ADRA1B P35368 4/20 0.40

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
SCHEMBL20147416 0.88 OPRM1 (0.50) OPRM1OPRD1OPRK1OPRL1SSTR5
SCHEMBL20206008 0.83 OPRM1 (0.47) OPRM1OPRD1OPRK1OPRL1
SCHEMBL20158624 0.83 OPRM1 (0.47) OPRM1OPRD1OPRK1OPRL1
SCHEMBL13231734 0.80 OPRM1 (0.43) OPRM1OPRD1OPRK1OPRL1SSTR5
SCHEMBL28914608 0.77 OPRL1 (0.43) OPRM1OPRD1OPRK1OPRL1SSTR5
SCHEMBL3814747 0.76 OPRM1 (0.45) OPRM1OPRD1OPRK1OPRL1SSTR5
SCHEMBL7328780 0.75 SLC6A4 (0.57) OPRM1OPRD1OPRK1OPRL1GRIN2B
SCHEMBL7328785 0.75 SLC6A4 (0.57) OPRM1OPRD1OPRK1OPRL1GRIN2B
SCHEMBL7329242 0.74 GRIN2B (0.56) OPRM1OPRD1OPRK1OPRL1SSTR5
SCHEMBL9963240 0.74 GRIN2B (0.54) OPRM1OPRD1OPRK1OPRL1GRIN2B

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10441581-B2 Substituted pyrazolo[1,5-A]pyridine compounds as RET kinase inhibitors ARRAY BIOPHARMA INC. (US) 2019-10-15 US disclosed
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 (2 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-10441581-B2 Substituted pyrazolo[1,5-A]pyridine compounds as RET kinase inhibitors RET, BRAF, RAF1 OPRM1 3497/4885OPRD1 2909/4885OPRK1 2369/4885
US-20180133207-A1 SUBSTITUTED PYRAZOLO[1,5-A]PYRIDINE COMPOUNDS AS RET KINASE INHIBITORS RET, BRAF, RAF1 OPRM1 3497/4885OPRD1 2909/4885OPRK1 2369/4885

“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.