SCHEMBL20147553

SCHEMBL20147553

CC(C)N1CCC(C)(NC(=O)c2cccc(CN(C)C)c2)CC1

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 2/20 0.46
RET P07949 1/20 0.44
MCHR1 Q99705 1/20 0.41
ROCK2 O75116 9/20 0.39
KMT2A Q03164 1/20 0.39
HDAC1 Q13547 1/20 0.39
ROCK1 Q13464 1/20 0.38
CYP3A4 P08684 2/20 0.38
CHRM3 P20309 1/20 0.38
CYP2C19 P33261 1/20 0.37
KDM4E B2RXH2 1/20 0.37
SPHK2 Q9NRA0 1/20 0.37
SPHK1 Q9NYA1 1/20 0.37
EGFR P00533 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
SCHEMBL20069767 0.87 RET (0.45) RETMCHR1ROCK2KMT2AHDAC1
SCHEMBL20147557 0.87 MCHR1 (0.43) RETMCHR1ROCK2KMT2AHDAC1
SCHEMBL20205757 0.86 RET (0.45) RETMCHR1ROCK2HDAC1ROCK1
SCHEMBL20147556 0.84 MCHR1 (0.45) HRH3RETMCHR1ROCK2KMT2A
SCHEMBL20147992 0.84 RET (0.44) RETMCHR1ROCK2HDAC1ROCK1
SCHEMBL20147571 0.80 CHRNA1 (0.48) KMT2ACYP3A4CYP2C19
SCHEMBL20147574 0.80 CYP2D6 (0.48) HDAC1CYP3A4CYP2C19KDM4E
SCHEMBL20147535 0.79 ATM (0.49) HRH3MCHR1KMT2AHDAC1CYP2C19
SCHEMBL20147586 0.79 KMT2A (0.53) MCHR1KMT2ACYP2C19
SCHEMBL20147573 0.77 KCNH2 (0.43) HRH3RETMCHR1ROCK2KMT2A

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 5 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-10881652-B2 Substituted pyrazolo[1,5-A]pyridine compounds as RET kinase inhibitors ARRAY BIOPHARMA INC. (US) 2021-01-05 US disclosed
US-20180148445-A1 SUBSTITUTED PYRAZOLO[1,5-A]PYRIDINE COMPOUNDS AS RET KINASE INHIBITORS ARRAY BIOPHARMA INC. 2018-05-31 US disclosed
US-20180133207-A1 SUBSTITUTED PYRAZOLO[1,5-A]PYRIDINE COMPOUNDS AS RET KINASE INHIBITORS ARRAY BIOPHARMA INC. 2018-05-17 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 (5 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 HRH3 1000/4885RET 1/4885MCHR1 1063/4885
US-20180148445-A1 SUBSTITUTED PYRAZOLO[1,5-A]PYRIDINE COMPOUNDS AS RET KINASE INHIBITORS RET, BRAF, RAF1 HRH3 1000/4885RET 1/4885MCHR1 1063/4885
US-11648243-B2 Substituted pyrazolo[1,5-A]pyridine compounds as RET kinase inhibitors RET, BRAF, RAF1 HRH3 1000/4885RET 1/4885MCHR1 1063/4885
US-20180133207-A1 SUBSTITUTED PYRAZOLO[1,5-A]PYRIDINE COMPOUNDS AS RET KINASE INHIBITORS RET, BRAF, RAF1 HRH3 1000/4885RET 1/4885MCHR1 1063/4885
US-20180134703-A1 SUBSTITUTED PYRAZOLO[1,5-A]PYRIDINE COMPOUNDS AS RET KINASE INHIBITORS RET, BRAF, RAF1 HRH3 1000/4885RET 1/4885MCHR1 1063/4885

“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.