SCHEMBL4484432

SCHEMBL4484432

CN(C(=O)CN)c1ccc(N/C(=C2\C(=O)Nc3cc(F)ccc32)c2ccccc2)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 2/20 0.42
CXCR1 P25024 1/20 0.37
CXCR2 P25025 1/20 0.37
PDGFRB P09619 2/20 0.37
TGM2 P21980 1/20 0.35
MAPT P10636 4/20 0.35
TP53 P04637 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
RXFP1 Q9HBX9 1/20 0.35
AURKA O14965 1/20 0.35
PDGFRA P16234 1/20 0.35
KDR P35968 1/20 0.35
FLT3 P36888 1/20 0.35
AURKB Q96GD4 1/20 0.35
AURKC Q9UQB9 1/20 0.35
GABRP O00591 1/20 0.35
GABRD O14764 1/20 0.35
GABRA1 P14867 1/20 0.35
GABRB1 P18505 1/20 0.35
GABRG2 P18507 1/20 0.35

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
SCHEMBL4484437 1.00 BACE1 (0.42) BACE1CXCR1CXCR2PDGFRBTGM2
SCHEMBL4499405 0.92 BACE1 (0.42) BACE1CXCR1CXCR2PDGFRBTGM2
SCHEMBL4499408 0.92 BACE1 (0.42) BACE1CXCR1CXCR2PDGFRBTGM2
SCHEMBL4488538 0.91 BACE1 (0.42) BACE1CXCR1CXCR2PDGFRBTGM2
SCHEMBL4488536 0.91 BACE1 (0.42) BACE1CXCR1CXCR2PDGFRBTGM2
SCHEMBL4504430 0.90 BACE1 (0.41) BACE1CXCR1CXCR2PDGFRBTGM2
SCHEMBL4492734 0.90 BACE1 (0.41) BACE1CXCR1CXCR2PDGFRBTGM2
SCHEMBL4490351 0.89 BACE1 (0.41) BACE1CXCR1CXCR2PDGFRBTGM2
SCHEMBL4490347 0.89 BACE1 (0.41) BACE1CXCR1CXCR2PDGFRBTGM2
SCHEMBL4505730 0.89 GABRP (0.45) BACE1TGM2MAPTRXFP1KDR

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 BACE1 1615/4885CXCR1 389/4885CXCR2 663/4885

“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.