SCHEMBL2071764

SCHEMBL2071764

Cc1ccc2nsnc2c1S(=O)(=O)Nc1ccc(-c2cn(C3CCCC3)c3ncnc(N)c23)cc1F

nearest known ligand 0.51

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
NEK7 Q8TDX7 12/20 0.51
EGFR P00533 4/20 0.50
TEK Q02763 2/20 0.50
ERBB2 P04626 1/20 0.50
ERBB3 P21860 1/20 0.50
ERBB4 Q15303 1/20 0.50
RIPK2 O43353 1/20 0.47
ABL1 P00519 3/20 0.46
SRC P12931 3/20 0.46
ABL2 P42684 3/20 0.46
EIF2AK3 Q9NZJ5 2/20 0.45

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
SCHEMBL2074394 0.92 EGFR (0.49) NEK7EGFRTEKERBB2ERBB3
SCHEMBL2074912 0.89 NEK7 (0.51) NEK7EGFRTEKRIPK2ABL1
SCHEMBL2075838 0.88 EGFR (0.49) NEK7EGFRTEKERBB2ERBB3
SCHEMBL2076052 0.84 NEK7 (0.52) NEK7EGFRTEKERBB2ERBB3
SCHEMBL2075923 0.84 EGFR (0.63) NEK7EGFRTEKERBB2ERBB3
SCHEMBL12934154 0.82 NEK7 (0.52) NEK7EGFRTEKERBB2ERBB3
SCHEMBL12934155 0.82 NEK7 (0.59) NEK7EGFRTEKERBB2ERBB3
SCHEMBL2071940 0.82 EGFR (0.55) NEK7EGFRTEKERBB2ERBB3
SCHEMBL2074937 0.82 RIPK2 (0.53) NEK7EGFRTEKERBB2ERBB3
SCHEMBL12934129 0.81 TEK (0.65) NEK7EGFRTEKERBB2ERBB3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1114052-B1 4-AMINOPYRROLOPYRIMIDINES AS KINASE INHIBITORS ABBOTT GMBH & CO KG (DE) 2005-11-16 EP claimed
US-20030187001-A1 4-AMINOPYRROLOPYRIMIDINES AS KINASE INHIBITORS ABBVIE DEUTSCHLAND GMBH & CO KG (DE) 2003-10-02 US claimed
EP-1114052-A1 4-AMINOPYRROLOPYRIMIDINES AS KINASE INHIBITORS BASF AKTIENGESELLSCHAFT (DE) 2001-07-11 EP claimed
WO-2000017202-A1 4-AMINOPYRROLOPYRIMIDINES AS KINASE INHIBITORS BASF AKTIENGESELLSCHAFT (DE) 2000-03-30 WO claimed
US-7863444-B2 4-aminopyrrolopyrimidines as kinase inhibitors ABBOTT LABORATORIES (US) 2011-01-04 US disclosed
US-20050008640-A1 Method of treating transplant rejection ABBOTT LABORATORIES 2005-01-13 US disclosed
US-20030187001-A1 4-AMINOPYRROLOPYRIMIDINES AS KINASE INHIBITORS ABBVIE DEUTSCHLAND GMBH & CO KG (DE) 2003-10-02 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 (2 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-20050008640-A1 Method of treating transplant rejection LCK, ZAP70, FYN NEK7 3001/4885EGFR 818/4885TEK 1465/4885
US-20030187001-A1 4-AMINOPYRROLOPYRIMIDINES AS KINASE INHIBITORS LCK, PPP5C, DUSP1 NEK7 2079/4885EGFR 294/4885TEK 199/4885

“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.