SCHEMBL4492225

SCHEMBL4492225

COCCC(N)c1ccc(NC(=C2C(=O)Nc3cc(Cl)ccc32)c2ccccc2)cc1

nearest known ligand 0.37

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
F11 P03951 8/20 0.36
KLKB1 P03952 6/20 0.36
MEN1 O00255 1/20 0.36
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
KMT2A Q03164 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
PYGL P06737 1/20 0.35
RXFP1 Q9HBX9 1/20 0.35
CASP3 P42574 1/20 0.34
APLNR P35414 2/20 0.34
CES1 P23141 1/20 0.33
TP53 P04637 1/20 0.33
MDM2 Q00987 1/20 0.33
BACE1 P56817 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
SCHEMBL4495113 0.91 CES1 (0.36) NPC1RAB9AKMT2ARXFP1CASP3
SCHEMBL480642 0.89 KMT2A (0.39) MEN1NPC1RAB9AKMT2ARXFP1
SCHEMBL4491671 0.88 CES1 (0.34) NPC1RAB9AKMT2ARXFP1CASP3
SCHEMBL4496965 0.87 LRRK2 (0.37) F11MEN1KMT2ARXFP1CASP3
SCHEMBL4499903 0.86 CES1 (0.33) F11RXFP1CASP3CES1
SCHEMBL4488163 0.85 LRRK2 (0.36) F11RXFP1
SCHEMBL480519 0.85 RXFP1 (0.46) MEN1NPC1RAB9AKMT2ASMN1; SMN2
SCHEMBL4480932 0.85 RXFP1 (0.36) NPC1RAB9AKMT2ARXFP1CASP3
SCHEMBL4492820 0.85 PSEN1 (0.34) RXFP1CASP3CES1
SCHEMBL4491983 0.84 RXFP1 (0.38) MEN1NPC1RAB9AKMT2ASMN1; SMN2

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 F11 1885/4885KLKB1 2581/4885MEN1 1288/4885

“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.