SCHEMBL2921155

SCHEMBL2921155

Cc1ccc(S(=O)(=O)NC2C=CC(Br)=CN2CC(N)=O)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.38
EGFR P00533 1/20 0.37
ERBB2 P04626 1/20 0.37
F2 P00734 1/20 0.36
PRSS1 P07477 1/20 0.36
PRSS2 P07478 1/20 0.36
PRSS3 P35030 1/20 0.36
TSHR P16473 3/20 0.36
CYP3A4 P08684 1/20 0.36
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
MMP1 P03956 1/20 0.35
MMP2 P08253 1/20 0.35
MMP9 P14780 1/20 0.35
MMP8 P22894 1/20 0.35
MMP13 P45452 1/20 0.35
LMNA P02545 1/20 0.35
POLB P06746 1/20 0.35
RAB9A P51151 1/20 0.34
KMT2A Q03164 1/20 0.34

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
SCHEMBL22499169 0.91 ALDH1A1 (0.40) ALDH1A1F2PRSS1PRSS2PRSS3
SCHEMBL5253685 0.86 ALDH1A1 (0.38) ALDH1A1F2PRSS1PRSS2PRSS3
SCHEMBL2745538 0.84 KMT2A (0.36) ALDH1A1F2PRSS1PRSS2PRSS3
SCHEMBL22189756 0.81 ALDH1A1 (0.41) ALDH1A1F2PRSS1PRSS2PRSS3
SCHEMBL4289626 0.74 GPR17 (0.41) ALDH1A1CYP3A4LMNAPOLBKMT2A
SCHEMBL13789513 0.73 CA1 (0.36) ALDH1A1EGFRERBB2F2PRSS1
SCHEMBL2922463 0.64 EGFR (0.39) ALDH1A1EGFRERBB2F2PRSS1
SCHEMBL4859251 0.63 ALDH1A1 (0.61) ALDH1A1F2PRSS1PRSS2PRSS3
SCHEMBL170426 0.60 CA1 (0.59) ALDH1A1F2PRSS1PRSS2PRSS3
SCHEMBL25349264 0.60 ALDH1A1 (0.64) ALDH1A1CA2LMNAKMT2AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7820665-B2 Imidazopyridazine inhibitors of PI3 kinase for cancer treatment AMGEN INC. (US) 2010-10-26 US disclosed
EP-2231661-A1 INHIBITORS OF PI3 KINASE Amgen, Inc. (US) 2010-09-29 EP disclosed
WO-2009085230-A1 INHIBITORS OF PI3 KINASE AMGEN INC. (US) 2009-07-09 WO disclosed
US-20090163489-A1 Inhibitors of PI3 kinase AMGEN INC. 2009-06-25 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-20090163489-A1 Inhibitors of PI3 kinase PIK3CA, PIK3CD, PIK3CG ALDH1A1 3415/4885EGFR 441/4885ERBB2 197/4885

“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.