SCHEMBL20147992

SCHEMBL20147992

CSN1CCC(C)(NC(=O)c2cccc(CN(C)C)c2)CC1

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
RET P07949 1/20 0.44
ROCK2 O75116 10/20 0.39
HDAC1 Q13547 1/20 0.39
MCHR1 Q99705 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
LMNA P02545 1/20 0.36
ANO1 Q5XXA6 1/20 0.36
TXK P42681 1/20 0.36
JAK3 P52333 1/20 0.36
BTK Q06187 1/20 0.36

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) RETROCK2HDAC1MCHR1ROCK1
SCHEMBL20205757 0.86 RET (0.45) RETROCK2HDAC1MCHR1ROCK1
SCHEMBL20147553 0.84 HRH3 (0.46) RETROCK2HDAC1MCHR1ROCK1
SCHEMBL20069766 0.74 PRMT5 (0.45) RETROCK2MCHR1ROCK1CHRM3
SCHEMBL21651933 0.72 MCHR1 (0.48) RETROCK2MCHR1ROCK1CHRM3
SCHEMBL18901187 0.72 LOXL2 (0.55) ROCK2ROCK1SPHK2SPHK1ANO1
SCHEMBL20147557 0.71 MCHR1 (0.43) RETROCK2HDAC1MCHR1ROCK1
SCHEMBL20147991 0.71 RET (0.46) RETROCK2MCHR1ROCK1CYP3A4
SCHEMBL6175213 0.71 SLC7A5 (0.56) ROCK2CYP3A4CYP2C19
SCHEMBL6581113 0.71 ALDH1A1 (0.54) ROCK2CYP3A4CYP2C19KDM4ELMNA

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-10441581-B2 Substituted pyrazolo[1,5-A]pyridine compounds as RET kinase inhibitors ARRAY BIOPHARMA INC. (US) 2019-10-15 US disclosed
US-20180133207-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-10441581-B2 Substituted pyrazolo[1,5-A]pyridine compounds as RET kinase inhibitors RET, BRAF, RAF1 RET 1/4885ROCK2 474/4885HDAC1 1094/4885
US-20180133207-A1 SUBSTITUTED PYRAZOLO[1,5-A]PYRIDINE COMPOUNDS AS RET KINASE INHIBITORS RET, BRAF, RAF1 RET 1/4885ROCK2 474/4885HDAC1 1094/4885

“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.