SCHEMBL4484691

SCHEMBL4484691

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

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FPR3 P25089 2/20 0.36
FPR2 P25090 2/20 0.36
PTPRC P08575 2/20 0.36
S1PR1 P21453 1/20 0.36
CTNNB1 P35222 1/20 0.36
TCF7L2 Q9NQB0 1/20 0.36
MAPT P10636 3/20 0.35
TDP1 Q9NUW8 1/20 0.35
KDM4E B2RXH2 1/20 0.34
ALDH1A1 P00352 1/20 0.34
GAA P10253 1/20 0.34
VSIR Q9H7M9 1/20 0.34
NR1H2 P55055 1/20 0.33
LMNA P02545 1/20 0.33
HPGD P15428 1/20 0.33
CCNB2 O95067 1/20 0.33
CDK1 P06493 1/20 0.33
HSP90AA1 P07900 1/20 0.33
CCNB1 P14635 1/20 0.33
CCR6 P51684 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
SCHEMBL4493463 0.92 FPR2 (0.34) FPR3FPR2S1PR1CTNNB1TCF7L2
SCHEMBL4493172 0.91 S1PR1 (0.37) PTPRCS1PR1CTNNB1TCF7L2MAPT
SCHEMBL4494092 0.91 CTNNB1 (0.42) PTPRCS1PR1CTNNB1TCF7L2MAPT
SCHEMBL3147765 0.83 LTA4H (0.36) PTPRCS1PR1CTNNB1TCF7L2MAPT
SCHEMBL4490758 0.83 CCNB2 (0.37) FPR2MAPTCCNB2CDK1HSP90AA1
SCHEMBL4490752 0.83 CCNB2 (0.37) FPR2MAPTCCNB2CDK1HSP90AA1
SCHEMBL4486527 0.83 SLC2A1 (0.34) LMNA
SCHEMBL3160809 0.83 OPRM1 (0.36) PTPRCS1PR1CTNNB1TCF7L2MAPT
SCHEMBL4498038 0.83 BACE1 (0.38) S1PR1CTNNB1TCF7L2MAPTKDM4E
SCHEMBL225925 0.82 CTNNB1 (0.38) S1PR1CTNNB1TCF7L2MAPTTDP1

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 FPR3 1473/4885FPR2 2159/4885PTPRC 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.