SCHEMBL4495850

SCHEMBL4495850

CC(C)N(C(=O)CN1CCN(C(=O)OC(C)(C)C)CC1)c1ccc(N/C(=C2\C(=O)Nc3cc(Cl)ccc32)c2ccccc2)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
MDM4 O15151 1/20 0.36
MDM2 Q00987 1/20 0.36
ALDH1A1 P00352 4/20 0.36
MAPT P10636 4/20 0.36
TDP1 Q9NUW8 2/20 0.36
GFER P55789 1/20 0.36
ABCB1 P08183 1/20 0.35
CRBN Q96SW2 1/20 0.35
ANO1 Q5XXA6 1/20 0.35
HTT P42858 2/20 0.35
LMNA P02545 1/20 0.35
TP53 P04637 1/20 0.35
CHRM2 P08172 1/20 0.34
CHRM4 P08173 1/20 0.34
CHRM1 P11229 1/20 0.34
CHRM3 P20309 1/20 0.34
NPC1 O15118 1/20 0.34
MAPK1 P28482 1/20 0.34

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
SCHEMBL4499569 0.92 DRD4 (0.40) MEN1KMT2AMDM4MDM2ALDH1A1
SCHEMBL4504792 0.92 MEN1 (0.38) MEN1KMT2AMDM4MDM2ALDH1A1
SCHEMBL2572004 0.91 AAK1 (0.42) MEN1KMT2AALDH1A1MAPTABCB1
SCHEMBL480510 0.90 ATM (0.41) ALDH1A1MAPTLMNAMAPK1
SCHEMBL480509 0.90 ATM (0.41) ALDH1A1MAPTLMNAMAPK1
SCHEMBL4500868 0.89 SMN1; SMN2 (0.43) ALDH1A1MAPTTDP1GFERLMNA
SCHEMBL4500873 0.89 SMN1; SMN2 (0.43) ALDH1A1MAPTTDP1GFERLMNA
SCHEMBL4497110 0.87 SLC2A1 (0.36) ALDH1A1MAPTTDP1GFERHTT
SCHEMBL4497113 0.87 SLC2A1 (0.36) ALDH1A1MAPTTDP1GFERHTT
SCHEMBL4491928 0.87 MEN1 (0.39) MEN1KMT2AMDM4MDM2MAPT

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 MEN1 1288/4885KMT2A 3530/4885MDM4 1588/4885

“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.