SCHEMBL22857005

SCHEMBL22857005

COc1ncc(OC2CN(C)C2)cn1

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TLR7 Q9NYK1 2/20 0.35
RET P07949 1/20 0.35
ACACB O00763 1/20 0.34
PDGFRB P09619 1/20 0.34
PDGFRA P16234 1/20 0.34
FFAR1 O14842 1/20 0.33
ALDH1A1 P00352 1/20 0.33
GAA P10253 1/20 0.33
KMT2A Q03164 1/20 0.33
OXTR P30559 1/20 0.32
CSF1R P07333 2/20 0.32
CYP1A2 P05177 1/20 0.32
FTO Q9C0B1 1/20 0.32

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
SCHEMBL20158541 0.88 PIK3CD (0.40) TLR7
SCHEMBL20069132 0.83 HRH3 (0.46) PDGFRBPDGFRA
SCHEMBL20069135 0.83 ACACB (0.38) RETACACBFFAR1
SCHEMBL20205805 0.81 RET (0.35) RETACACBPDGFRBPDGFRAFFAR1
SCHEMBL20158636 0.79 ACACB (0.36) RETACACBPDGFRBPDGFRAFFAR1
SCHEMBL20147967 0.75 MCHR1 (0.40) TLR7RETACACBALDH1A1GAA
SCHEMBL20152045 0.74 HRH3 (0.45)
SCHEMBL20147969 0.74 RET (0.41) RETPDGFRBPDGFRA
SCHEMBL10289475 0.74 GRIN1 (0.46)
SCHEMBL20147450 0.73 HRH3 (0.51)

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 TLR7 2484/4885RET 1/4885ACACB 4835/4885

“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.