SCHEMBL13755241

SCHEMBL13755241

Cc1[nH]c(/C=C2\C(=O)Nc3ccc(S(=O)(=O)N(C)C)cc32)c(C)c1C(=O)NCCN1CCCC1

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDR P35968 15/20 0.74
PDGFRB P09619 11/20 0.74
FGFR1 P11362 9/20 0.74
TLK2 Q86UE8 3/20 0.74
PRKAA1 Q13131 8/20 0.59
PRKAA2 P54646 7/20 0.59
MET P08581 4/20 0.58
FLT3 P36888 3/20 0.58
AURKB Q96GD4 3/20 0.58
EGFR P00533 3/20 0.55
PTK2B Q14289 3/20 0.55
PLK4 O00444 2/20 0.55
DCLK1 O15075 2/20 0.55
PDPK1 O15530 2/20 0.55
DAPK3 O43293 2/20 0.55
ROCK2 O75116 2/20 0.55
RPS6KA5 O75582 2/20 0.55
RPS6KA4 O75676 2/20 0.55
MAP4K4 O95819 2/20 0.55
CHEK2 O96017 2/20 0.55

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
SCHEMBL31672500 1.00 KDR (0.74) KDRPDGFRBFGFR1TLK2PRKAA1
SCHEMBL2114225 1.00 KDR (0.74) KDRPDGFRBFGFR1TLK2PRKAA1
SCHEMBL5396485 0.89 KDR (0.58) KDRPDGFRBFGFR1TLK2PRKAA1
SCHEMBL140610 0.86 KDR (0.70) KDRPDGFRBFGFR1TLK2PRKAA1
SCHEMBL31672571 0.86 KDR (0.75) KDRPDGFRBFGFR1TLK2PRKAA1
SCHEMBL13755242 0.86 KDR (0.75) KDRPDGFRBFGFR1TLK2PRKAA1
SCHEMBL2115790 0.86 KDR (0.75) KDRPDGFRBFGFR1TLK2PRKAA1
SCHEMBL12335807 0.86 KDR (0.77) KDRPDGFRBFGFR1TLK2PRKAA1
SCHEMBL13755224 0.85 PDGFRB (0.81) KDRPDGFRBFGFR1TLK2PRKAA1
Toceranib SCHEMBL2116670 0.85 PDGFRB (1.00) KDRPDGFRBFGFR1TLK2PRKAA1

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
US-20180000771-A1 AGENT FOR PREVENTING AND/OR TREATING AMYOTROPHIC LATERAL SCLEROSIS KYOTO UNIVERSITY (JP) 2018-01-04 US disclosed
US-7572924-B2 Pyrrole substituted 2-indolinone protein kinase inhibitors SUGEN, INC. (US) 2009-08-11 US disclosed
US-7572924-B2 Pyrrole substituted 2-indolinone protein kinase inhibitors SUGEN, INC. (US) 2009-08-11 US disclosed
US-7320996-B2 Indolinone protein kinase inhibitors and cyclooxygenase inhibitors for use in combination therapy for the treatment of cancer SUGEN, INC (US) 2008-01-22 US disclosed
US-20070010569-A1 Pyrrole substituted 2-indolinone protein kinase inhibitors SUGEN, INC. & PHARMACIA & UPJOHN CO. 2007-01-11 US disclosed
US-20070010569-A1 Pyrrole substituted 2-indolinone protein kinase inhibitors SUGEN, INC. & PHARMACIA & UPJOHN CO. 2007-01-11 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 (2 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-20180000771-A1 AGENT FOR PREVENTING AND/OR TREATING AMYOTROPHIC LATERAL SCLEROSIS WEE2, WEE1, ERBB2 KDR 648/4885PDGFRB 40/4885FGFR1 48/4885
US-20070010569-A1 Pyrrole substituted 2-indolinone protein kinase inhibitors PDPK1, PLK2, PNCK KDR 1387/4885PDGFRB 1034/4885FGFR1 1227/4885

“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.