SCHEMBL1300733

SCHEMBL1300733

O=C1Nc2cc(F)ccc2/C1=C\c1cccc(C(F)(F)F)c1

nearest known ligand 0.56

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PDGFRB P09619 3/20 0.56
KDR P35968 1/20 0.51
RXRA P19793 1/20 0.51
CISD1 Q9NZ45 2/20 0.50
TTR P02766 1/20 0.50
PIM1 P11309 1/20 0.50
PIM2 Q9P1W9 1/20 0.50
TGM2 P21980 1/20 0.49
PLK4 O00444 1/20 0.48
PLK1 P53350 1/20 0.48
MDM2 Q00987 1/20 0.46
NTRK1 P04629 2/20 0.46
NTRK3 Q16288 2/20 0.46

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
SCHEMBL1300738 1.00 PDGFRB (0.56) PDGFRBKDRRXRACISD1TTR
SCHEMBL29638301 0.90 FLT3 (0.54) KDRRXRACISD1TTRPIM1
SCHEMBL14674946 0.90 FLT3 (0.54) KDRRXRACISD1TTRPIM1
SCHEMBL14674947 0.90 FLT3 (0.54) KDRRXRACISD1TTRPIM1
SCHEMBL14675079 0.87 PDGFRB (0.64) PDGFRBKDRPIM1PIM2TGM2
SCHEMBL14675080 0.87 PDGFRB (0.64) PDGFRBKDRPIM1PIM2TGM2
SCHEMBL14679985 0.86 CISD1 (0.49) PDGFRBKDRRXRACISD1TTR
SCHEMBL29875451 0.86 LRRK2 (0.54) CISD1TTRPIM1PIM2PLK4
SCHEMBL1301170 0.86 LRRK2 (0.54) CISD1TTRPIM1PIM2PLK4
SCHEMBL1301174 0.86 LRRK2 (0.54) CISD1TTRPIM1PIM2PLK4

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
EP-2350001-A1 NOVEL BENZYLIDENE-INDOLINONE AND THEIR MEDICAL AND DIAGNOSTIC USES National University of Singapore (SG) 2011-08-03 EP claimed
WO-2010044753-A1 NOVEL BENZYLIDENE-INDOLINONE AND THEIR MEDICAL AND DIAGNOSTIC USES NATIONAL UNIVERSITY OF SINGAPORE (SG) 2010-04-22 WO claimed
US-8877946-B2 Benzylidene-indolinone compounds and their medical use NATIONAL UNIVERSITY OF SINGAPORE (SG) 2014-11-04 US disclosed
US-20130035364-A1 BENZYLIDENE-INDOLINONE COMPOUNDS AND THEIR MEDICAL USE NATIONAL UNIVERSITY OF SINGAPORE (SG) 2013-02-07 US disclosed
US-20110269812-A1 NOVEL BENZYLIDENE-INDOLINONE AND THEIR MEDICAL AND DIAGNOSTIC USES AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) 2011-11-03 US disclosed
EP-2350001-A1 NOVEL BENZYLIDENE-INDOLINONE AND THEIR MEDICAL AND DIAGNOSTIC USES National University of Singapore (SG) 2011-08-03 EP disclosed
WO-2010044753-A1 NOVEL BENZYLIDENE-INDOLINONE AND THEIR MEDICAL AND DIAGNOSTIC USES NATIONAL UNIVERSITY OF SINGAPORE (SG) 2010-04-22 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 (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-20130035364-A1 BENZYLIDENE-INDOLINONE COMPOUNDS AND THEIR MEDICAL USE ERBB2, ABL1, IGF1R PDGFRB 11/4885KDR 81/4885RXRA 1518/4885
US-20110269812-A1 NOVEL BENZYLIDENE-INDOLINONE AND THEIR MEDICAL AND DIAGNOSTIC USES SBK3, DMPK, PHKG2 PDGFRB 920/4885KDR 936/4885RXRA 4383/4885

“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.