SCHEMBL4504249

SCHEMBL4504249

CN(C)Cc1ccc(NC(=C2C(=O)Nc3cc(Cl)ccc32)c2ccc(CNS(C)(=O)=O)cc2)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LSS P48449 1/20 0.44
F10 P00742 2/20 0.36
KLKB1 P03952 1/20 0.36
KMT2A Q03164 4/20 0.35
TRPV1 Q8NER1 1/20 0.35
CES1 P23141 1/20 0.35
MAPT P10636 4/20 0.35
POLB P06746 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
MEN1 O00255 2/20 0.35
TP53 P04637 1/20 0.35
CYP11B2 P19099 1/20 0.35
GAA P10253 1/20 0.34
ADRB2 P07550 1/20 0.34
ADRB1 P08588 1/20 0.34
ADRB3 P13945 1/20 0.34
ROCK2 O75116 3/20 0.33
CA12 O43570 1/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33

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
SCHEMBL4504245 1.00 LSS (0.44) LSSF10KLKB1KMT2ATRPV1
SCHEMBL227370 0.90 LSS (0.48) LSSF10KLKB1KMT2ACES1
SCHEMBL227369 0.90 LSS (0.48) LSSF10KLKB1KMT2ACES1
SCHEMBL4493148 0.90 BACE1 (0.37) LSSKMT2ATRPV1MAPTPOLB
SCHEMBL4493143 0.90 BACE1 (0.37) LSSKMT2ATRPV1MAPTPOLB
SCHEMBL4499333 0.89 KMT2A (0.44) LSSKMT2AMAPTPOLBSMN1; SMN2
SCHEMBL4499336 0.89 KMT2A (0.44) LSSKMT2AMAPTPOLBSMN1; SMN2
SCHEMBL4488110 0.87 LSS (0.43) LSSF10KLKB1CES1MAPT
SCHEMBL4488105 0.87 LSS (0.43) LSSF10KLKB1CES1MAPT
SCHEMBL227264 0.87 LSS (0.52) LSSF10KLKB1KMT2AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7514468-B2 Indolinone derivatives substituted in the 6 position, the preparation thereof and their use as pharmaceutical compositions BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2009-04-07 US disclosed
US-20060194813-A1 Indolinone derivatives substituted in the 6 position, the preparation thereof and their use as pharmaceutical compositions BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2006-08-31 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 (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-20060194813-A1 Indolinone derivatives substituted in the 6 position, the preparation thereof and their use as pharmaceutical compositions KDR, FLT1, EGFR LSS 2944/4885F10 2068/4885KLKB1 2581/4885

“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.