SCHEMBL3877593

SCHEMBL3877593

NC(=O)c1[nH]c2c([N+](=O)[O-])cccc2c1-c1ccc(NC(=O)Nc2cc(C(F)(F)F)ccc2F)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RIPK1 Q13546 1/20 0.51
KDR P35968 10/20 0.49
PDGFRB P09619 4/20 0.49
CA12 O43570 2/20 0.48
CA1 P00915 2/20 0.48
CA2 P00918 2/20 0.48
CA9 Q16790 2/20 0.48
FLT3 P36888 6/20 0.47
KIT P10721 5/20 0.47
LCK P06239 3/20 0.46
CSF1R P07333 3/20 0.46
FLT1 P17948 3/20 0.46
FLT4 P35916 2/20 0.46
FGFR1 P11362 2/20 0.46
FGFR3 P22607 2/20 0.46
PDGFRA P16234 1/20 0.46
FGFR2 P21802 1/20 0.46
FGFR4 P22455 1/20 0.46
TEK Q02763 1/20 0.46
FBP1 P09467 3/20 0.45

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
SCHEMBL3880427 0.87 RIPK1 (0.54) RIPK1KDRPDGFRBCA12CA1
SCHEMBL3877955 0.87 RIPK1 (0.56) RIPK1KDRPDGFRBCA12CA1
SCHEMBL3877985 0.84 RIPK1 (0.51) RIPK1KDRPDGFRBCA12CA1
SCHEMBL3878015 0.83 RIPK1 (0.52) RIPK1KDRPDGFRBCA12CA1
SCHEMBL3880531 0.83 KDR (0.57) RIPK1KDRPDGFRBCA12CA1
SCHEMBL3879329 0.83 CA12 (0.49) RIPK1KDRPDGFRBCA12CA1
SCHEMBL3878453 0.81 RIPK1 (0.48) RIPK1KDRPDGFRBCA12CA1
SCHEMBL1876299 0.80 RIPK1 (0.59) RIPK1KDRPDGFRBCA12CA1
SCHEMBL13761320 0.80 RIPK1 (0.47) RIPK1KDRPDGFRBCA12CA1
SCHEMBL1881162 0.80 KDR (0.52) RIPK1KDRPDGFRBCA12CA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7566736-B2 Substituted indoles, compositions containing them, method for the production thereof and their use AVENTIS PHARMA S.A. (FR) 2009-07-28 US claimed
US-20070259910-A1 Substituted Indoles, Compositions Containing Them, Method for the Production Thereof and Their Use AVENTIS PHARMA S.A. (FR) 2007-11-08 US claimed
EP-1841762-A1 SUBSTITUTED INDOLES, COMPOSITIONS CONTAINING THEM, METHOD FOR THE PRODUCTION THEREOF AND THEIR USE Aventis Pharma S.A. (FR) 2007-10-10 EP claimed
WO-2006061493-A1 SUBSTITUTED INDOLES, COMPOSITIONS CONTAINING THEM, METHOD FOR THE PRODUCTION THEREOF AND THEIR USE AVENTIS PHARMA S.A. (FR) 2006-06-15 WO claimed
US-7566736-B2 Substituted indoles, compositions containing them, method for the production thereof and their use AVENTIS PHARMA S.A. (FR) 2009-07-28 US disclosed
US-7566736-B2 Substituted indoles, compositions containing them, method for the production thereof and their use AVENTIS PHARMA S.A. (FR) 2009-07-28 US disclosed
US-20070259910-A1 Substituted Indoles, Compositions Containing Them, Method for the Production Thereof and Their Use AVENTIS PHARMA S.A. (FR) 2007-11-08 US disclosed
US-20070259910-A1 Substituted Indoles, Compositions Containing Them, Method for the Production Thereof and Their Use AVENTIS PHARMA S.A. (FR) 2007-11-08 US disclosed
EP-1841762-A1 SUBSTITUTED INDOLES, COMPOSITIONS CONTAINING THEM, METHOD FOR THE PRODUCTION THEREOF AND THEIR USE Aventis Pharma S.A. (FR) 2007-10-10 EP disclosed
WO-2006061493-A1 SUBSTITUTED INDOLES, COMPOSITIONS CONTAINING THEM, METHOD FOR THE PRODUCTION THEREOF AND THEIR USE AVENTIS PHARMA S.A. (FR) 2006-06-15 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-20070259910-A1 Substituted Indoles, Compositions Containing Them, Method for the Production Thereof and Their Use IDO1, RB1, IDO2 RIPK1 2658/4885KDR 1690/4885PDGFRB 1177/4885

“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.