SCHEMBL20069575

SCHEMBL20069575

COc1ccc(OC2CCN(C)CC2)nn1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR1D P28221 1/20 0.47
HTR1B P28222 1/20 0.47
HTR1F P30939 1/20 0.47
HRH3 Q9Y5N1 2/20 0.45
SMN1; SMN2 Q16637 1/20 0.42
TDO2 P48775 1/20 0.41
CHRM2 P08172 2/20 0.40
CHRM1 P11229 2/20 0.40
CHRM4 P08173 1/20 0.40
CHRM5 P08912 1/20 0.40
CHRM3 P20309 1/20 0.40
HTR1A P08908 1/20 0.40
ADRA2A P08913 1/20 0.40
CYP2D6 P10635 1/20 0.40
DRD1 P21728 1/20 0.40
SLC6A2 P23975 1/20 0.40
ADRA1A P35348 1/20 0.40
OPRM1 P35372 1/20 0.40
DRD3 P35462 1/20 0.40
SLC6A3 Q01959 1/20 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
SCHEMBL20412702 0.86 HRH3 (0.43) HRH3SMN1; SMN2TDO2CHRM2CHRM1
SCHEMBL30986545 0.85 HRH3 (0.42) HRH3SMN1; SMN2TDO2CHRM2CHRM1
SCHEMBL30986470 0.85 HRH3 (0.42) HTR1DHTR1BHTR1FHRH3SMN1; SMN2
SCHEMBL20069137 0.81 CHRNB2 (0.38) HTR1DHTR1BHTR1FCHRM4CHRM3
SCHEMBL20148035 0.81 OXTR (0.39) HTR1DHTR1BHTR1FHRH3SMN1; SMN2
SCHEMBL20147424 0.81 HRH3 (0.52) HRH3
SCHEMBL29571300 0.81 GPR119 (0.41) HRH3CHRM4
SCHEMBL20069134 0.81 TDO2 (0.43) HTR1DHTR1BHTR1FHRH3SMN1; SMN2
SCHEMBL20158603 0.79 TDO2 (0.48) HRH3SMN1; SMN2TDO2CHRM4TGFBR1
SCHEMBL5268383 0.79 GPR119 (0.47) HRH3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11648243-B2 Substituted pyrazolo[1,5-A]pyridine compounds as RET kinase inhibitors ARRAY BIOPHARMA INC. (US) 2023-05-16 US disclosed
US-11168090-B2 Substituted pyrazolo[1,5-a]pyrazines as RET kinase inhibitors ARRAY BIOPHARMA INC. (US) 2021-11-09 US disclosed
US-20200055860-A1 SUBSTITUTED PYRAZOLO[1,5-A]PYRAZINE COMPOUNDS AS RET KINASE INHIBITORS ARRAY BIOPHARMA INC 2020-02-20 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 (3 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-20200055860-A1 SUBSTITUTED PYRAZOLO[1,5-A]PYRAZINE COMPOUNDS AS RET KINASE INHIBITORS RET, BRAF, ROR1 HTR1D 1412/4885HTR1B 2332/4885HTR1F 1985/4885
US-11648243-B2 Substituted pyrazolo[1,5-A]pyridine compounds as RET kinase inhibitors RET, BRAF, RAF1 HTR1D 2367/4885HTR1B 3360/4885HTR1F 2585/4885
US-11168090-B2 Substituted pyrazolo[1,5-a]pyrazines as RET kinase inhibitors RET, BRAF, ROR1 HTR1D 1403/4885HTR1B 2313/4885HTR1F 1985/4885

“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.