SCHEMBL13712003

SCHEMBL13712003

Cc1[nH]c(C=C2C(=O)Nc3ccc(Br)cc32)c(C)c1C(=O)NCC(O)CN1CCOCC1

nearest known ligand 0.83

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDGFRB P09619 12/20 0.83
KDR P35968 11/20 0.83
FGFR1 P11362 7/20 0.83
PRKAA2 P54646 5/20 0.83
PRKAA1 Q13131 5/20 0.83
TLK2 Q86UE8 4/20 0.83
KIT P10721 3/20 0.83
RIOK2 Q9BVS4 2/20 0.83
TLK1 Q9UKI8 2/20 0.83
EGFR P00533 2/20 0.83
FLT1 P17948 2/20 0.83
RIPK1 Q13546 2/20 0.83
BMPR1B O00238 1/20 0.83
PLK4 O00444 1/20 0.83
STK25 O00506 1/20 0.83
CIT O14578 1/20 0.83
RIOK3 O14730 1/20 0.83
CHEK1 O14757 1/20 0.83
IKBKB O14920 1/20 0.83
GAK O14976 1/20 0.83

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
SCHEMBL6726631 1.00 PDGFRB (0.83) PDGFRBKDRFGFR1PRKAA2PRKAA1
Su-014813 SCHEMBL4500940 0.91 KDR (1.00) PDGFRBKDRFGFR1PRKAA2PRKAA1
SCHEMBL4486899 0.91 KDR (0.83) PDGFRBKDRFGFR1PRKAA2PRKAA1
SCHEMBL4492712 0.91 KDR (0.83) PDGFRBKDRFGFR1PRKAA2PRKAA1
Su-014813 SCHEMBL2334610 0.91 KDR (1.00) PDGFRBKDRFGFR1PRKAA2PRKAA1
Su-014813 SCHEMBL2334599 0.91 KDR (1.00) PDGFRBKDRFGFR1PRKAA2PRKAA1
SCHEMBL5527704 0.91 KDR (0.83) PDGFRBKDRFGFR1PRKAA2PRKAA1
SCHEMBL4486888 0.91 KDR (0.83) PDGFRBKDRFGFR1PRKAA2PRKAA1
Su-014813 SCHEMBL1249521 0.91 KDR (1.00) PDGFRBKDRFGFR1PRKAA2PRKAA1
Su-014813 SCHEMBL902507 0.91 KDR (1.00) PDGFRBKDRFGFR1PRKAA2PRKAA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7582756-B2 3-(4-amidopyrrol-2-ylmethylidene)-2-indolinone derivatives as protein kinase inhibitors SUGEN, INC. (US) 2009-09-01 US disclosed
US-20080045709-A1 3-(4-AMIDOPYRROL-2-YLMETHYLIDENE)-2-INDOLINONE DERIVATIVES AS PROTEIN KINASE INHIBITORS SUGEN, INC. 2008-02-21 US disclosed
US-7256189-B2 3-(4-amidopyrrol-2-ylmethylidene)-2-indolinone der derivatives as protein kinase inhibitors SUGEN, INC. (US) 2007-08-14 US disclosed
US-7179910-B2 3-(4-amidopyrrol-2-ylmethlidene)-2-indolinone derivatives as protein kinase inhibitors AGOURON PHARMACEUTICALS, INC. (US) 2007-02-20 US disclosed
US-20070027149-A1 3-(4-amidopyrrol-2-ylmethylidene)-2-indolinone der derivatives as protein kinase inhibitors SUGEN, INC. 2007-02-01 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-20080045709-A1 3-(4-AMIDOPYRROL-2-YLMETHYLIDENE)-2-INDOLINONE DERIVATIVES AS PROTEIN KINASE INHIBITORS MAP4K2, MAP4K3, CDK2 PDGFRB 687/4885KDR 762/4885FGFR1 848/4885
US-20070027149-A1 3-(4-amidopyrrol-2-ylmethylidene)-2-indolinone der derivatives as protein kinase inhibitors PDPK1, MAP4K2, MAP4K3 PDGFRB 1062/4885KDR 1334/4885FGFR1 1199/4885

“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.