SCHEMBL14670594

SCHEMBL14670594

Cc1cnc(Cl)nc1N[C@H](CO)c1cc(F)cc(F)c1

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ USP1 O94782 1/20 0.42
▸ WDR48 Q8TAF3 1/20 0.42
▸ NTRK1 P04629 4/20 0.38
▸ MAP4K1 Q92918 1/20 0.35
▸ CCNT1 O60563 4/20 0.35
▸ CDK9 P50750 4/20 0.35
▸ RPS6KB1 P23443 1/20 0.34
▸ MAPK1 P28482 4/20 0.33
▸ LMNA P02545 1/20 0.33
▸ HPGD P15428 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ XPO1 O14980 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.33
▸ ROCK2 O75116 1/20 0.32
▸ CDK2 P24941 2/20 0.32
▸ CDK7 P50613 1/20 0.32
▸ MAPK3 P27361 1/20 0.31

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
SCHEMBL27717397 0.87 NTRK1 (0.48) USP1WDR48NTRK1MAP4K1CCNT1
SCHEMBL14670588 0.87 ALDH1A1 (0.43) NTRK1MAP4K1CCNT1CDK9RPS6KB1
SCHEMBL14670400 0.87 NTRK1 (0.45) NTRK1MAP4K1CCNT1CDK9RPS6KB1
SCHEMBL14670673 0.87 NTRK1 (0.45) NTRK1MAP4K1CCNT1CDK9RPS6KB1
SCHEMBL14670585 0.82 USP1 (0.51) USP1WDR48CCNT1CDK9RPS6KB1
SCHEMBL30930030 0.82 USP1 (0.51) USP1WDR48CCNT1CDK9RPS6KB1
SCHEMBL14670663 0.82 USP1 (0.51) USP1WDR48CCNT1CDK9RPS6KB1
SCHEMBL14670591 0.81 USP1 (0.39) USP1WDR48NTRK1MAP4K1CCNT1
SCHEMBL14670670 0.79 ALDH1A1 (0.39) MAPK1ALDH1A1L3MBTL1
SCHEMBL14670672 0.79 NTRK1 (0.41) NTRK1MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140179664-A1 Heterocyclyl Pyrimidine Analogues As JAK Inhibitors CELLZOME LIMITED (GB) 2014-06-26 — — US disclosed
US-20140179664-A1 Heterocyclyl Pyrimidine Analogues As JAK Inhibitors CELLZOME LIMITED (GB) 2014-06-26 — — US disclosed
WO-2013014162-A1 HETEROCYCLYL PYRIMIDINE ANALOGUES AS JAK INHIBITORS CELLZOME LIMITED (GB) 2013-01-31 — — WO 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-20140179664-A1 Heterocyclyl Pyrimidine Analogues As JAK Inhibitors JAK1, JAK3, JAK2 USP1 2368/4885WDR48 2995/4885NTRK1 4690/4885

“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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