SCHEMBL25504182

SCHEMBL25504182

COc1ccnc(C(=O)NC2(C)CCN(S(C)=S)CC2)n1

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
RET P07949 7/20 0.42
SCN10A Q9Y5Y9 3/20 0.36
EGLN1 Q9GZT9 1/20 0.35
MCHR1 Q99705 1/20 0.34
AURKA O14965 1/20 0.33
LCK P06239 1/20 0.33
MET P08581 1/20 0.33
KDR P35968 1/20 0.33
TEK Q02763 1/20 0.33
AURKB Q96GD4 1/20 0.33
MTNR1A P48039 1/20 0.32
MTNR1B P49286 1/20 0.32
MGLL Q99685 2/20 0.32
HTR1A P08908 1/20 0.31
HTR3A P46098 1/20 0.31
AXL P30530 1/20 0.30

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
SCHEMBL20147638 0.82 RET (0.43) RETSCN10AEGLN1MCHR1AURKA
SCHEMBL21651964 0.81 RET (0.42) RETMCHR1MGLLHTR1A
SCHEMBL20070353 0.70 RET (0.42) RETEGLN1MCHR1
SCHEMBL20070356 0.69 RET (0.42) RET
SCHEMBL21651995 0.69 MCHR1 (0.45) RETMCHR1
SCHEMBL6635914 0.68 KDR (0.44) KDRMTNR1AMTNR1B
SCHEMBL20147633 0.68 MCHR1 (0.42) RETEGLN1MCHR1
SCHEMBL20931377 0.67 P2RX7 (0.52) MTNR1AMTNR1B
SCHEMBL21651990 0.67 RET (0.43) RETMCHR1
SCHEMBL20147634 0.67 RET (0.41) RETMCHR1

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-11648243-B2 Substituted pyrazolo[1,5-A]pyridine compounds as RET kinase inhibitors ARRAY BIOPHARMA INC. (US) 2023-05-16 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-11648243-B2 Substituted pyrazolo[1,5-A]pyridine compounds as RET kinase inhibitors RET, BRAF, RAF1 RET 1/4885SCN10A 2190/4885EGLN1 2633/4885

“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.