SCHEMBL4499192

SCHEMBL4499192

CC(C)(C)OC(=O)NCc1ccc(N/C(=C2\C(=O)Nc3cc(Cl)ccc32)c2ccccc2)cc1

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 2/20 0.44
HDAC1 Q13547 3/20 0.43
GAA P10253 1/20 0.40
FPR3 P25089 1/20 0.39
FPR2 P25090 1/20 0.39
MAPT P10636 7/20 0.39
TDP1 Q9NUW8 7/20 0.39
KDM4E B2RXH2 3/20 0.39
MAPK1 P28482 1/20 0.38
NPSR1 Q6W5P4 3/20 0.38
CCKBR P32239 1/20 0.37
HDAC6 Q9UBN7 1/20 0.37
BRD4 O60885 1/20 0.37
CREBBP Q92793 1/20 0.37
XBP1 P17861 1/20 0.37
GPR55 Q9Y2T6 1/20 0.37
AKT1 P31749 1/20 0.36

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
SCHEMBL4487854 0.93 PDCD1 (0.43) NAMPTHDAC1GAAFPR3FPR2
SCHEMBL4493906 0.91 MARS1 (0.39) NAMPTHDAC1FPR3FPR2MAPT
SCHEMBL4504168 0.90 NAMPT (0.44) NAMPTHDAC1FPR3FPR2MAPT
SCHEMBL2574498 0.89 HDAC1 (0.45) NAMPTHDAC1FPR3FPR2MAPT
SCHEMBL4493172 0.88 S1PR1 (0.37) MAPTTDP1KDM4ECCKBR
SCHEMBL4486527 0.87 SLC2A1 (0.34) NPSR1CCKBR
SCHEMBL480573 0.87 NAMPT (0.48) NAMPTHDAC1GAAMAPTTDP1
SCHEMBL8187365 0.85 HDAC1 (0.42) NAMPTHDAC1MAPTTDP1KDM4E
SCHEMBL6321899 0.83 NAMPT (0.43) NAMPTHDAC1FPR3FPR2MAPT
SCHEMBL6403737 0.83 NAMPT (0.43) NAMPTHDAC1FPR3FPR2MAPT

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 NAMPT 3483/4885HDAC1 3369/4885GAA 4394/4885

“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.