SCHEMBL4493463

SCHEMBL4493463

CC(C)(C)OC(=O)CCNCc1ccc(N/C(=C2\C(=O)Nc3cc(Br)ccc32)c2ccccc2)cc1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FPR2 P25090 5/20 0.34
FPR3 P25089 3/20 0.34
KDM4E B2RXH2 2/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
CCNB2 O95067 2/20 0.33
CDK1 P06493 2/20 0.33
CCNB1 P14635 2/20 0.33
CCNB3 Q8WWL7 2/20 0.33
GSK3B P49841 1/20 0.33
HDAC1 Q13547 1/20 0.33
PDCD1 Q15116 1/20 0.33
CD274 Q9NZQ7 1/20 0.33
NR1H2 P55055 1/20 0.33
HSP90AA1 P07900 1/20 0.32
CCR6 P51684 1/20 0.32
ACHE P22303 1/20 0.32
RET P07949 1/20 0.32
TP53 P04637 1/20 0.32
MAPT P10636 1/20 0.32

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
SCHEMBL3147765 0.92 LTA4H (0.36) MEN1KMT2AHDAC1PDCD1CD274
SCHEMBL4484691 0.92 FPR3 (0.36) FPR2FPR3KDM4ECCNB2CDK1
SCHEMBL4486527 0.91 SLC2A1 (0.34) MEN1KMT2APDCD1CD274POLB
SCHEMBL3160809 0.91 OPRM1 (0.36) HDAC1PDCD1CD274NR1H2MAPT
SCHEMBL4498038 0.91 BACE1 (0.38) KDM4EPDCD1CD274RETTP53
SCHEMBL2572833 0.90 HIF1A (0.38) KDM4EKMT2ARETTP53MAPT
SCHEMBL4482769 0.89 KDR (0.35) PDCD1CD274
SCHEMBL3159980 0.88 MAPT (0.43) KDM4EMEN1KMT2AMAPTSMN1; SMN2
SCHEMBL4493172 0.83 S1PR1 (0.37) KDM4EMEN1KMT2AMAPTCTNNB1
SCHEMBL4494092 0.83 CTNNB1 (0.42) MEN1KMT2ATP53MAPTSMN1; 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 FPR2 2159/4885FPR3 1473/4885KDM4E 1648/4885

“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.