SCHEMBL1300997

SCHEMBL1300997

O=C1Nc2ccc(Cl)cc2C1=Cc1cccc(C(F)(F)F)c1

nearest known ligand 0.68

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
LRRK2 Q5S007 8/20 0.68
PSEN1 P49768 5/20 0.58
PSEN2 P49810 5/20 0.58
APH1B Q8WW43 5/20 0.58
NCSTN Q92542 5/20 0.58
APH1A Q96BI3 5/20 0.58
PSENEN Q9NZ42 5/20 0.58
PDGFRB P09619 2/20 0.54
EGFR P00533 2/20 0.54
ERBB2 P04626 2/20 0.54
RPS6KA3 P51812 1/20 0.53

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
SCHEMBL14674469 1.00 LRRK2 (0.68) LRRK2PSEN1PSEN2APH1BNCSTN
SCHEMBL1301174 0.90 LRRK2 (0.54) LRRK2PSEN1PSEN2APH1BNCSTN
SCHEMBL1301170 0.90 LRRK2 (0.54) LRRK2PSEN1PSEN2APH1BNCSTN
SCHEMBL29875451 0.90 LRRK2 (0.54) LRRK2PSEN1PSEN2APH1BNCSTN
SCHEMBL14674946 0.86 FLT3 (0.54) LRRK2RPS6KA3
SCHEMBL14674947 0.86 FLT3 (0.54) LRRK2RPS6KA3
SCHEMBL29638301 0.86 FLT3 (0.54) LRRK2RPS6KA3
SCHEMBL14674619 0.86 LRRK2 (0.70) LRRK2PSEN1PSEN2APH1BNCSTN
SCHEMBL14674620 0.86 LRRK2 (0.70) LRRK2PSEN1PSEN2APH1BNCSTN
SCHEMBL14673807 0.85 LRRK2 (0.64) LRRK2PSEN1PSEN2APH1BNCSTN

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
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-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-20130035364-A1 BENZYLIDENE-INDOLINONE COMPOUNDS AND THEIR MEDICAL USE NATIONAL UNIVERSITY OF SINGAPORE (SG) 2013-02-07 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 LRRK2 19/4885PSEN1 3380/4885PSEN2 3088/4885
US-20110269812-A1 NOVEL BENZYLIDENE-INDOLINONE AND THEIR MEDICAL AND DIAGNOSTIC USES SBK3, DMPK, PHKG2 LRRK2 191/4885PSEN1 3016/4885PSEN2 3133/4885

“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.