SCHEMBL1940259

SCHEMBL1940259

Nc1ncnc2[nH]cc(C(=O)c3cccc(NS(=O)(=O)c4ccc(F)c(Cl)c4)c3)c12

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BTK Q06187 2/20 0.53
EGFR P00533 1/20 0.47
ERBB2 P04626 1/20 0.47
ERBB3 P21860 1/20 0.47
TEK Q02763 1/20 0.47
ERBB4 Q15303 1/20 0.47
CYP3A4 P08684 5/20 0.46
MEN1 O00255 3/20 0.44
KMT2A Q03164 3/20 0.44
CYP2C19 P33261 3/20 0.43
BRAF P15056 2/20 0.42
TNNI3K Q59H18 2/20 0.42
PABPC1 P11940 1/20 0.42
PDGFRB P09619 1/20 0.41
CYP2C9 P11712 2/20 0.41
ALDH1A1 P00352 1/20 0.41
LMNA P02545 1/20 0.41
MAPT P10636 1/20 0.41
PLG P00747 1/20 0.40
PLAU P00749 1/20 0.40

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
SCHEMBL1941090 0.92 BTK (0.55) BTKEGFRERBB2ERBB3TEK
SCHEMBL1940038 0.92 BTK (0.55) BTKEGFRERBB2ERBB3TEK
SCHEMBL1941891 0.90 BTK (0.59) BTKEGFRERBB2ERBB3TEK
SCHEMBL1941126 0.89 BTK (0.58) BTKEGFRERBB2ERBB3TEK
SCHEMBL1940319 0.88 BTK (0.59) BTKEGFRERBB2ERBB3TEK
SCHEMBL1941175 0.88 BTK (0.59) BTKEGFRERBB2ERBB3TEK
SCHEMBL1941393 0.87 BTK (0.58) BTKEGFRERBB2ERBB3TEK
SCHEMBL1941525 0.85 EGFR (0.62) BTKEGFRERBB2ERBB3TEK
SCHEMBL1940738 0.85 BTK (0.53) BTKEGFRERBB2ERBB3TEK
SCHEMBL1941592 0.85 BTK (0.69) BTKEGFRERBB2ERBB3TEK

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-1578751-B1 PYRROLOPYRIMIDINE DERIVATIVES PFIZER PROD INC (US) 2011-06-15 EP disclosed
US-7271262-B2 Pyrrolopyrimidine derivatives PFIZER INC (US) 2007-09-18 US disclosed
CN-1726218-A Pyrrolopyrimidine derivatives PFIZER PROD INC (US) 2006-01-25 CN disclosed
EP-1578751-A1 PYRROLOPYRIMIDINE DERIVATIVES Pfizer Products Inc. (US) 2005-09-28 EP disclosed
US-20050037999-A1 Pyrrolopyrimidine derivatives PFIZER INC 2005-02-17 US disclosed
WO-2004056830-A1 PYRROLOPYRIMIDINE DERIVATIVES PFIZER PRODUCTS INC. (US) 2004-07-08 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-20050037999-A1 Pyrrolopyrimidine derivatives CCNA1, CCNT1, TP53 BTK 1708/4885EGFR 2758/4885ERBB2 2738/4885

“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.