SCHEMBL20158635

SCHEMBL20158635

CCN1CCC(Oc2cnc(OC)cn2)CC1

nearest known ligand 0.46

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 5/20 0.46
GPR119 Q8TDV5 9/20 0.44
LIPE Q05469 1/20 0.40
CDK1 P06493 1/20 0.39
CDK4 P11802 1/20 0.39
CDK6 Q00534 1/20 0.39
PDGFRB P09619 2/20 0.38
PDGFRA P16234 2/20 0.38
CHEK1 O14757 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
SCHEMBL18202730 0.86 HRH3 (0.44) HRH3GPR119LIPECDK1CDK4
SCHEMBL20069134 0.82 TDO2 (0.43) HRH3GPR119PDGFRBPDGFRA
SCHEMBL20147451 0.78 HRH3 (0.52) HRH3GPR119
SCHEMBL22856982 0.78 TDO2 (0.46) HRH3GPR119LIPE
SCHEMBL20205807 0.77 HRH3 (0.51) HRH3PDGFRBPDGFRACHEK1
SCHEMBL20147952 0.75 CHRM4 (0.48) HRH3
SCHEMBL10819391 0.74 HRH3 (0.48) HRH3LIPE
Hydrochloric Acid SCHEMBL20138455 0.72 PDGFRB (0.41) PDGFRBPDGFRA
SCHEMBL25503004 0.72 HRH3 (0.49) HRH3
SCHEMBL18822846 0.72 HRH3 (0.56) HRH3PDGFRBPDGFRACHEK1

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-10172845-B2 Substituted pyrazolo[1,5-A]pyridine compounds as RET kinase inhibitors ARRAY BIOPHARMA INC. (US) 2019-01-08 US disclosed
US-20180134703-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-10172845-B2 Substituted pyrazolo[1,5-A]pyridine compounds as RET kinase inhibitors RET, BRAF, RAF1 HRH3 1000/4885GPR119 1905/4885LIPE 4758/4885
US-20180134703-A1 SUBSTITUTED PYRAZOLO[1,5-A]PYRIDINE COMPOUNDS AS RET KINASE INHIBITORS RET, BRAF, RAF1 HRH3 1000/4885GPR119 1905/4885LIPE 4758/4885

“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.