SCHEMBL9928287

SCHEMBL9928287

CC1CCN(Cc2c[nH]c3ncnc(Cl)c23)CC1C

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHEK1 O14757 2/20 0.40
LRRK2 Q5S007 7/20 0.39
JAK3 P52333 4/20 0.39
JAK2 O60674 3/20 0.39
JAK1 P23458 1/20 0.39
TYK2 P29597 1/20 0.39
AKT1 P31749 5/20 0.39
KHK P50053 1/20 0.37
STK3 Q13188 3/20 0.36
STK4 Q13043 2/20 0.36
CDC7 O00311 1/20 0.35
PLK4 O00444 1/20 0.35
AURKA O14965 1/20 0.35
PDPK1 O15530 1/20 0.35
ROCK2 O75116 1/20 0.35
PAK4 O96013 1/20 0.35
CHEK2 O96017 1/20 0.35
EGFR P00533 1/20 0.35
NTRK1 P04629 1/20 0.35
PRKCG P05129 1/20 0.35

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
SCHEMBL9928283 0.86 DRD2 (0.46) CHEK1LRRK2AKT1LCKMET
SCHEMBL9928305 0.82 TTBK1 (0.39) LRRK2JAK3JAK2JAK1TYK2
SCHEMBL9928286 0.82 CHEK1 (0.40) CHEK1LRRK2JAK3AKT1KHK
SCHEMBL9943149 0.80 BTK (0.42) JAK3JAK2JAK1
SCHEMBL30974955 0.79 ALOX15 (0.51) CHEK1LRRK2JAK2AKT1STK3
SCHEMBL9896856 0.78 BTK (0.40) LRRK2JAK3JAK2JAK1STK3
SCHEMBL9896860 0.78 BTK (0.40) LRRK2JAK3JAK2JAK1STK3
SCHEMBL9896857 0.78 BTK (0.40) LRRK2JAK3JAK2JAK1STK3
SCHEMBL9928284 0.77 CHEK1 (0.42) CHEK1LRRK2AKT1STK3STK4
SCHEMBL13471644 0.76 MTAP (0.37) CHEK1LRRK2JAK3JAK2AKT1

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-20120149902-A1 PYRROLO[2,3-D]PYRIMIDINE DERIVATIVE UBE INDUSTRIES, LTD. (JP) 2012-06-14 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-20120149902-A1 PYRROLO[2,3-D]PYRIMIDINE DERIVATIVE ERBB2, EGFR, FGFR1 CHEK1 259/4885LRRK2 458/4885JAK3 204/4885

“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.