SCHEMBL23126232

SCHEMBL23126232

COc1ccc(NC(=O)N2C3CC2CN(C(C)(C)C)C3)cn1

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
RET P07949 2/20 0.49
ALDH1A1 P00352 3/20 0.48
KDM4E B2RXH2 2/20 0.48
LMNA P02545 2/20 0.48
RAB9A P51151 2/20 0.48
NPC1 O15118 2/20 0.48
HTT P42858 1/20 0.48
KMT2A Q03164 6/20 0.46
MEN1 O00255 5/20 0.46
MAPT P10636 2/20 0.46
PABPC1 P11940 3/20 0.44
NAMPT P43490 2/20 0.43
POLB P06746 2/20 0.43
IDO1 P14902 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
AR P10275 1/20 0.42

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
SCHEMBL20153172 0.87 ALDH1A1 (0.51) RETALDH1A1KDM4ELMNARAB9A
SCHEMBL20069826 0.84 KMT2A (0.49) RETALDH1A1KDM4ELMNARAB9A
SCHEMBL20069825 0.84 KDM4E (0.48) RETALDH1A1KDM4ELMNARAB9A
SCHEMBL22811913 0.82 LMNA (0.51) RETALDH1A1KDM4ELMNARAB9A
SCHEMBL22030762 0.81 RET (0.47) RETALDH1A1KDM4ELMNARAB9A
SCHEMBL20205857 0.80 RAB9A (0.48) RETALDH1A1KDM4ELMNARAB9A
SCHEMBL20149644 0.73 CHRNB2 (0.49) RETKMT2AMEN1
SCHEMBL20152350 0.71 RET (0.47) RET
SCHEMBL1348379 0.70 KMT2A (0.61) ALDH1A1KDM4ELMNARAB9ANPC1
SCHEMBL31734621 0.70 PIK3CA (0.46) RETKMT2AIDO1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10953005-B1 Substituted pyrazolo[1,5-a]pyridine compounds as RET kinase inhibitors ARRAY BIOPHARMA INC. (US) 2021-03-23 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 (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-10953005-B1 Substituted pyrazolo[1,5-a]pyridine compounds as RET kinase inhibitors RET, ROR1, BRAF RET 1/4885ALDH1A1 2868/4885KDM4E 889/4885

“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.