SCHEMBL20069366

SCHEMBL20069366

CN1CCC(Oc2ccc(F)cn2)C1

nearest known ligand 0.56

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TDO2 P48775 2/20 0.54
HTR2C P28335 1/20 0.45
HTR2B P41595 1/20 0.45
TLR7 Q9NYK1 2/20 0.43
ATM Q13315 1/20 0.43
ATR Q13535 1/20 0.43
OXTR P30559 1/20 0.41
AVPR1A P37288 1/20 0.41
CHRM2 P08172 1/20 0.41
CHRM4 P08173 1/20 0.41
CHRM5 P08912 1/20 0.41
CHRM1 P11229 1/20 0.41
CHRM3 P20309 1/20 0.41
HRH3 Q9Y5N1 2/20 0.41

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
SCHEMBL19865665 1.00 TDO2 (0.54) TDO2HTR2CHTR2BTLR7ATM
SCHEMBL19865633 1.00 TDO2 (0.54) TDO2HTR2CHTR2BTLR7ATM
SCHEMBL20145024 0.93 TDO2 (0.48) TDO2HTR2CHTR2BTLR7ATM
SCHEMBL20147962 0.92 TDO2 (0.61) TDO2TLR7OXTRAVPR1AHRH3
SCHEMBL16382664 0.89 TDO2 (0.45) TDO2TLR7OXTRAVPR1A
SCHEMBL20152055 0.84 HRH3 (0.48) TDO2ATMATROXTRAVPR1A
SCHEMBL19862567 0.84 HRH3 (0.48) TDO2ATMATROXTRAVPR1A
SCHEMBL19862569 0.84 HRH3 (0.48) TDO2ATMATROXTRAVPR1A
SCHEMBL20147441 0.83 TDO2 (0.45) TDO2OXTRAVPR1AHRH3
SCHEMBL20147458 0.81 HRH3 (0.56) TDO2HRH3

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-20180148445-A1 SUBSTITUTED PYRAZOLO[1,5-A]PYRIDINE COMPOUNDS AS RET KINASE INHIBITORS ARRAY BIOPHARMA INC. 2018-05-31 US disclosed
WO-2018071454-A1 SUBSTITUTED PYRAZOLO[1,5-A]PYRIDINE COMPOUNDS AS RET KINASE INHIBITORS ANDREWS STEVEN W (US) 2018-04-19 WO 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-20180148445-A1 SUBSTITUTED PYRAZOLO[1,5-A]PYRIDINE COMPOUNDS AS RET KINASE INHIBITORS RET, BRAF, RAF1 TDO2 4376/4885HTR2C 3701/4885HTR2B 3567/4885

“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.