SCHEMBL5033066

SCHEMBL5033066

CSc1ncc2cc(-c3c(Cl)ccc(NC(=O)c4cccc(C(F)(F)F)c4)c3Cl)c(=O)[nH]c2n1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNQ3 O43525 2/20 0.44
KCNQ2 O43526 2/20 0.44
KCNE1 P15382 2/20 0.44
KCNQ1 P51787 2/20 0.44
KCNQ5 Q9NR82 1/20 0.43
DDR2 Q16832 1/20 0.43
BRAF P15056 6/20 0.41
CSF1R P07333 5/20 0.41
JAK2 O60674 1/20 0.41
PDGFRB P09619 1/20 0.41
FGFR1 P11362 1/20 0.41
CYP2C9 P11712 1/20 0.41
EPHB4 P54760 1/20 0.41
PTK2 Q05397 1/20 0.41
MAPK14 Q16539 1/20 0.41
KDR P35968 1/20 0.41
ALDH1A1 P00352 1/20 0.41
KIT P10721 1/20 0.41
GAA P10253 1/20 0.40
CYP1A2 P05177 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
SCHEMBL5040123 0.86 DDR2 (0.54) KCNQ3KCNQ2KCNE1KCNQ1KCNQ5
SCHEMBL5033059 0.85 SYK (0.51) DDR2BRAFCSF1RJAK2PDGFRB
SCHEMBL928169 0.84 BRAF (0.45) KCNQ3KCNQ2KCNE1KCNQ1KCNQ5
SCHEMBL14614834 0.82 FGFR1 (0.42) KCNQ3KCNQ2KCNE1KCNQ1KCNQ5
SCHEMBL927380 0.80 FGFR1 (0.53) PDGFRBFGFR1
SCHEMBL14011408 0.80 CSF1R (0.47) KCNQ3KCNQ2KCNE1KCNQ1KCNQ5
SCHEMBL5040080 0.79 GAA (0.45) KCNQ3KCNQ2KCNE1KCNQ1KCNQ5
SCHEMBL29536840 0.76 FGFR1 (0.45) DDR2BRAFCSF1RJAK2PDGFRB
SCHEMBL5659394 0.76 FGFR1 (0.45) DDR2BRAFCSF1RJAK2PDGFRB
SCHEMBL14011448 0.74 WEE1 (0.65) DDR2BRAFCSF1RJAK2PDGFRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7449582-B2 Compounds and compositions as protein kinase inhibitors IRM LLC (BM) 2008-11-11 US disclosed
US-7449582-B2 Compounds and compositions as protein kinase inhibitors IRM LLC (BM) 2008-11-11 US disclosed
US-7449582-B2 Compounds and compositions as protein kinase inhibitors IRM LLC (BM) 2008-11-11 US disclosed
EP-1673343-A4 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS IRM LLC (BM) 2008-09-10 EP disclosed
EP-1673343-A2 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS IRM LLC (BM) 2006-06-28 EP disclosed
US-20050187230-A1 Compounds and compositions as protein kinase inhibitors IRM LLC (BM) 2005-08-25 US disclosed
WO-2005034869-A2 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS IRM LLC (BM) 2005-04-21 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-20050187230-A1 Compounds and compositions as protein kinase inhibitors FYN, LCK, SRC KCNQ3 2533/4885KCNQ2 2157/4885KCNE1 3182/4885

“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.