SCHEMBL4493172

SCHEMBL4493172

CC(C)(C)OC(=O)CNCc1ccc(N/C(=C2\C(=O)Nc3cc(Cl)ccc32)c2ccccc2)cc1

nearest known ligand 0.37

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
S1PR1 P21453 1/20 0.37
MAPT P10636 2/20 0.36
PTPRC P08575 2/20 0.36
CTNNB1 P35222 1/20 0.35
TCF7L2 Q9NQB0 1/20 0.35
TDP1 Q9NUW8 1/20 0.34
CETP P11597 1/20 0.34
VSIR Q9H7M9 1/20 0.34
CCKBR P32239 1/20 0.33
RXFP1 Q9HBX9 1/20 0.33
KDM4E B2RXH2 1/20 0.33
MEN1 O00255 1/20 0.33
ALDH1A1 P00352 1/20 0.33
KMT2A Q03164 1/20 0.33
KDR P35968 2/20 0.33
FLT4 P35916 1/20 0.33
FLT3 P36888 1/20 0.33
LRRK2 Q5S007 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
SCHEMBL4486527 0.92 SLC2A1 (0.34) CCKBRRXFP1MEN1KMT2AKDR
SCHEMBL4484691 0.91 FPR3 (0.36) S1PR1MAPTPTPRCCTNNB1TCF7L2
SCHEMBL4494092 0.90 CTNNB1 (0.42) S1PR1MAPTPTPRCCTNNB1TCF7L2
SCHEMBL4499192 0.88 NAMPT (0.44) MAPTTDP1CCKBRKDM4E
SCHEMBL4487854 0.88 PDCD1 (0.43)
SCHEMBL4493906 0.86 MARS1 (0.39) MAPTTDP1KDM4EMEN1KMT2A
SCHEMBL4493365 0.86 CES1 (0.39) MAPTCETPRXFP1KDM4EMEN1
SCHEMBL4493369 0.86 CES1 (0.39) MAPTCETPRXFP1KDM4EMEN1
SCHEMBL4493713 0.85 LMNA (0.45) MAPT
Trifluoroacetic Acid SCHEMBL4486702 0.83 SLC2A1 (0.38) MAPTCTNNB1TCF7L2RXFP1KDM4E

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 S1PR1 1200/4885MAPT 545/4885PTPRC 420/4885

“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.