SCHEMBL1939807

SCHEMBL1939807

CC(C)n1cc(C(=O)c2cccc(NS(=O)(=O)c3cccc(F)c3)c2)c2c(N)ncnc21

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDGFRB P09619 1/20 0.62
EGFR P00533 4/20 0.56
ERBB2 P04626 4/20 0.56
ERBB3 P21860 4/20 0.56
TEK Q02763 4/20 0.56
ERBB4 Q15303 4/20 0.56
NTRK1 P04629 4/20 0.54
NTRK2 Q16620 3/20 0.54
NTRK3 Q16288 2/20 0.54
KCNH2 Q12809 3/20 0.53
PDPK1 O15530 5/20 0.47
POLB P06746 1/20 0.46
KDR P35968 1/20 0.45
RET P07949 3/20 0.44
ALDH1A1 P00352 1/20 0.44
AKT1 P31749 4/20 0.44
MTOR P42345 4/20 0.44
LMNA P02545 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
LCK P06239 1/20 0.43

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
SCHEMBL1941214 0.94 PDGFRB (0.63) PDGFRBEGFRERBB2ERBB3TEK
SCHEMBL1940398 0.92 PDGFRB (0.63) PDGFRBEGFRERBB2ERBB3TEK
SCHEMBL1940727 0.91 PDGFRB (0.66) PDGFRBEGFRERBB2ERBB3TEK
SCHEMBL4078127 0.91 NTRK1 (0.58) PDGFRBEGFRERBB2ERBB3TEK
SCHEMBL1940563 0.91 PDGFRB (0.63) PDGFRBEGFRERBB2ERBB3TEK
SCHEMBL1940933 0.91 PDGFRB (0.63) PDGFRBEGFRERBB2ERBB3TEK
SCHEMBL1940382 0.90 PDGFRB (0.69) PDGFRBEGFRERBB2ERBB3TEK
SCHEMBL1941276 0.90 EGFR (0.57) PDGFRBEGFRERBB2ERBB3TEK
SCHEMBL1941233 0.89 PDGFRB (0.59) PDGFRBEGFRERBB2ERBB3TEK
SCHEMBL1939654 0.89 PDGFRB (0.65) PDGFRBEGFRERBB2ERBB3TEK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1578751-B1 PYRROLOPYRIMIDINE DERIVATIVES PFIZER PROD INC (US) 2011-06-15 EP claimed
US-7271262-B2 Pyrrolopyrimidine derivatives PFIZER INC (US) 2007-09-18 US claimed
CN-1726218-A Pyrrolopyrimidine derivatives PFIZER PROD INC (US) 2006-01-25 CN claimed
EP-1578751-A1 PYRROLOPYRIMIDINE DERIVATIVES Pfizer Products Inc. (US) 2005-09-28 EP claimed
US-20050037999-A1 Pyrrolopyrimidine derivatives PFIZER INC 2005-02-17 US claimed
WO-2004056830-A1 PYRROLOPYRIMIDINE DERIVATIVES PFIZER PRODUCTS INC. (US) 2004-07-08 WO claimed
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 PDGFRB 2465/4885EGFR 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.