SCHEMBL13041320

SCHEMBL13041320

Cc1c(-c2nc3ccccc3n2S(=O)(=O)C(F)(F)F)c(=O)n(C)c2ccccc12

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDGFRB P09619 2/20 0.40
KDR P35968 2/20 0.40
ALDH3A1 P30838 2/20 0.38
KDM4E B2RXH2 4/20 0.38
SMN1; SMN2 Q16637 3/20 0.38
GAA P10253 2/20 0.38
ALDH1A1 P00352 2/20 0.38
HPGD P15428 1/20 0.38
FGFR1 P11362 1/20 0.38
PTK2 Q05397 1/20 0.37
MAPK14 Q16539 1/20 0.37
LMNA P02545 2/20 0.37
NTRK1 P04629 2/20 0.37
KMT2A Q03164 1/20 0.37
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
CXCL8 P10145 1/20 0.37
NOD2 Q9HC29 1/20 0.37
NOD1 Q9Y239 1/20 0.37
CYP1A2 P05177 1/20 0.37

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
SCHEMBL13041323 0.85 KDR (0.36) PDGFRBKDRALDH3A1KDM4ESMN1; SMN2
SCHEMBL13041381 0.71 TP53 (0.48) KDM4ESMN1; SMN2GAAALDH1A1HPGD
SCHEMBL3377478 0.67 PDGFRB (0.47) PDGFRBKDM4ESMN1; SMN2GAAALDH1A1
SCHEMBL7897644 0.67 ALDH1A1 (0.43) KDM4ESMN1; SMN2GAAALDH1A1HPGD
SCHEMBL29559577 0.65 KDM4E (0.55) PDGFRBKDRKDM4ESMN1; SMN2GAA
SCHEMBL28634325 0.65 KDM4E (0.55) PDGFRBKDRKDM4ESMN1; SMN2GAA
SCHEMBL20670034 0.65 GPR3 (0.54) KDRKDM4ESMN1; SMN2GAAALDH1A1
SCHEMBL2830065 0.63 ALDH1A1 (0.45) KDRKDM4ESMN1; SMN2GAAALDH1A1
SCHEMBL31202730 0.63 ALDH1A1 (0.45) KDRKDM4ESMN1; SMN2GAAALDH1A1
SCHEMBL12071395 0.62 GAA (0.53) PDGFRBKDRKDM4ESMN1; SMN2GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7825132-B2 Inhibition of FGFR3 and treatment of multiple myeloma NOVARTIS VACCINES AND DIAGNOSTICS, INC. (US) 2010-11-02 US disclosed
US-20090281100-A1 Benzimidazole quinolinones and uses thereof BARSANTI PAUL A 2009-11-12 US disclosed
US-7470709-B2 Benzimidazole quinolinones and uses thereof NOVARTIS VACCINES AND DIAGNOSTICS, INC. (US) 2008-12-30 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-20090281100-A1 Benzimidazole quinolinones and uses thereof GAA, ALPI, IL4I1 PDGFRB 3508/4885KDR 4671/4885ALDH3A1 82/4885

“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.