SCHEMBL23768151

SCHEMBL23768151

CCC(C)(C)Nc1ccnc(OC)n1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PLK1 P53350 1/20 0.38
▸ LYN P07948 1/20 0.37
▸ SRC P12931 1/20 0.37
▸ BTK Q06187 1/20 0.37
▸ TLR8 Q9NR97 1/20 0.37
▸ NUDT1 P36639 2/20 0.36
▸ MAPK8 P45983 4/20 0.35
▸ MAP4K1 Q92918 1/20 0.34
▸ MEN1 O00255 1/20 0.33
▸ NPC1 O15118 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.33
▸ LMNA P02545 1/20 0.33
▸ MAPT P10636 1/20 0.33
▸ MAPK1 P28482 1/20 0.33
▸ RAB9A P51151 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ HRH3 Q9Y5N1 1/20 0.33
▸ LATS1 O95835 1/20 0.33
▸ LATS2 Q9NRM7 1/20 0.33
▸ EGFR P00533 1/20 0.33

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
SCHEMBL21017395 0.82 ALDH1A1 (0.37) PLK1LYNSRCBTKNUDT1
SCHEMBL26551523 0.77 TLR8 (0.44) LYNSRCBTKTLR8NUDT1
SCHEMBL1154553 0.74 CYP1A2 (0.51) LYNSRCBTKMEN1NPC1
SCHEMBL28136437 0.73 MALT1 (0.51) PLK1MAP4K1CCNE2CDK4CCND1
SCHEMBL21017097 0.73 PLK1 (0.38) PLK1TLR8NUDT1HRH3LATS1
SCHEMBL27147919 0.73 CYP1A2 (0.56) TLR8NUDT1ALDH1A1HRH3CLK4
SCHEMBL28158326 0.73 MEN1 (0.44) PLK1TLR8NUDT1MEN1NPC1
SCHEMBL16244502 0.73 ROCK1 (0.40) LYNSRCBTKTLR8NUDT1
SCHEMBL19150881 0.71 ADORA3 (0.46) MAPK8NPC1RAB9AKMT2A
SCHEMBL19116517 0.71 ADORA1 (0.44) LYNSRCBTKMAPK8MEN1

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-20210253554-A1 SULFONE PYRIDINE ALKYL AMIDE-SUBSTITUTED HETEROARYL COMPOUNDS BRISTOL-MYERS SQUIBB COMPANY 2021-08-19 — — 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-20210253554-A1 SULFONE PYRIDINE ALKYL AMIDE-SUBSTITUTED HETEROARYL COMPOUNDS TYK2, JAK3, JAK2 PLK1 1635/4885LYN 151/4885SRC 212/4885

“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.

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