SCHEMBL22857080

SCHEMBL22857080

CC(S)N1CC(Oc2ccc(C(F)(F)F)cc2)C1

nearest known ligand 0.44

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PDE9A O76083 3/20 0.44
ACACB O00763 10/20 0.42
LIPG Q9Y5X9 2/20 0.42
TEAD1 P28347 1/20 0.39
FPR2 P25090 1/20 0.38
PROKR1 Q8TCW9 1/20 0.38
LIPE Q05469 1/20 0.38
NAAA Q02083 1/20 0.37

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
SCHEMBL12049588 0.88 PDE9A (0.45) PDE9AACACBLIPGTEAD1
SCHEMBL20205883 0.83 PDE9A (0.41) PDE9AACACBLIPG
SCHEMBL20147887 0.81 PDE9A (0.43) PDE9AACACB
SCHEMBL10850371 0.80 PDE9A (0.46) PDE9AACACB
SCHEMBL12050034 0.79 LIPG (0.45) ACACBLIPGTEAD1FPR2PROKR1
SCHEMBL1741828 0.77 ACHE (0.48)
SCHEMBL12026509 0.76 SLC6A4 (0.44) PDE9AACACBLIPGTEAD1FPR2
SCHEMBL12026424 0.76 HRH3 (0.61)
SCHEMBL29090107 0.73 TEAD1 (0.59) TEAD1FPR2PROKR1LIPENAAA
SCHEMBL9596492 0.72 ACACB (0.50) ACACBLIPGTEAD1LIPE

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-10881652-B2 Substituted pyrazolo[1,5-A]pyridine compounds as RET kinase inhibitors ARRAY BIOPHARMA INC. (US) 2021-01-05 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-10881652-B2 Substituted pyrazolo[1,5-A]pyridine compounds as RET kinase inhibitors RET, BRAF, RAF1 PDE9A 1154/4885ACACB 4835/4885LIPG 4689/4885

“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.