SCHEMBL2071744

SCHEMBL2071744

Nc1ncnc2c1c(-c1ccc(NS(=O)(=O)c3ccc(Cl)cc3Cl)c(F)c1)cn2C1CCCC1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RIPK2 O43353 2/20 0.51
NEK7 Q8TDX7 12/20 0.51
EIF2AK3 Q9NZJ5 3/20 0.51
ABL1 P00519 3/20 0.49
EGFR P00533 3/20 0.49
SRC P12931 3/20 0.49
ABL2 P42684 3/20 0.49
JAK2 O60674 1/20 0.49
NTRK1 P04629 1/20 0.49
INSR P06213 1/20 0.49
LCK P06239 1/20 0.49
NPM1 P06748 1/20 0.49
CSF1R P07333 1/20 0.49
LYN P07948 1/20 0.49
RET P07949 1/20 0.49
IGF1R P08069 1/20 0.49
MET P08581 1/20 0.49
ROS1 P08922 1/20 0.49
PDGFRB P09619 1/20 0.49
KIT P10721 1/20 0.49

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
SCHEMBL2076003 0.94 RIPK2 (0.51) RIPK2NEK7EIF2AK3ABL1EGFR
SCHEMBL12934104 0.92 EIF2AK3 (0.54) RIPK2NEK7EIF2AK3ABL1EGFR
SCHEMBL2074412 0.91 EGFR (0.54) RIPK2NEK7EIF2AK3ABL1EGFR
SCHEMBL2074937 0.90 RIPK2 (0.53) RIPK2NEK7ABL1EGFRSRC
SCHEMBL2075211 0.90 NEK7 (0.49) RIPK2NEK7EIF2AK3ABL1EGFR
SCHEMBL12856461 0.90 TEK (0.62) RIPK2NEK7EIF2AK3ABL1EGFR
SCHEMBL6458902 0.90 TEK (0.62) RIPK2NEK7EIF2AK3ABL1EGFR
SCHEMBL2074983 0.90 EIF2AK3 (0.54) RIPK2NEK7EIF2AK3ABL1EGFR
SCHEMBL2074338 0.88 EIF2AK3 (0.53) RIPK2NEK7EIF2AK3ABL1EGFR
SCHEMBL2073071 0.88 EIF2AK3 (0.56) RIPK2NEK7EIF2AK3ABL1EGFR

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 6 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
US-7863444-B2 4-aminopyrrolopyrimidines as kinase inhibitors ABBOTT LABORATORIES (US) 2011-01-04 US disclosed
EP-1114052-B1 4-AMINOPYRROLOPYRIMIDINES AS KINASE INHIBITORS ABBOTT GMBH & CO KG (DE) 2005-11-16 EP 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 RIPK2 2575/4885NEK7 3001/4885EIF2AK3 3756/4885
US-20030187001-A1 4-AMINOPYRROLOPYRIMIDINES AS KINASE INHIBITORS LCK, PPP5C, DUSP1 RIPK2 1330/4885NEK7 2079/4885EIF2AK3 1113/4885

“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.