SCHEMBL4486757

SCHEMBL4486757

COC(=O)Nc1ccc(C(Nc2ccc(N(CCN(C)C)C(C)=O)cc2)=C2C(=O)Nc3cc(Cl)ccc32)cc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.36
POLB P06746 1/20 0.36
AHR P35869 1/20 0.36
LIMK1 P53667 1/20 0.35
UTS2R Q9UKP6 6/20 0.35
MAPT P10636 3/20 0.35
ALDH1A1 P00352 2/20 0.35
LRRK2 Q5S007 2/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
GAA P10253 1/20 0.33
HTT P42858 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
F11 P03951 1/20 0.33
PSEN1 P49768 2/20 0.33
PSEN2 P49810 2/20 0.33
APH1B Q8WW43 2/20 0.33
NCSTN Q92542 2/20 0.33
APH1A Q96BI3 2/20 0.33
PSENEN Q9NZ42 2/20 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
SCHEMBL4486749 1.00 NPC1 (0.36) NPC1POLBAHRLIMK1UTS2R
SCHEMBL4497737 0.95 NPC1 (0.35) NPC1POLBAHRLIMK1UTS2R
SCHEMBL4497740 0.95 NPC1 (0.35) NPC1POLBAHRLIMK1UTS2R
SCHEMBL226587 0.94 LIMK1 (0.39) NPC1POLBAHRLIMK1MAPT
SCHEMBL226588 0.94 LIMK1 (0.39) NPC1POLBAHRLIMK1MAPT
SCHEMBL4492738 0.92 LRRK2 (0.42) NPC1POLBAHRLIMK1MAPT
SCHEMBL4492731 0.92 LRRK2 (0.42) NPC1POLBAHRLIMK1MAPT
SCHEMBL4483948 0.92 LIMK1 (0.36) NPC1POLBAHRLIMK1MAPT
SCHEMBL4483954 0.92 LIMK1 (0.36) NPC1POLBAHRLIMK1MAPT
SCHEMBL4491326 0.91 LIMK1 (0.37) NPC1POLBAHRLIMK1MAPT

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 NPC1 3787/4885POLB 4146/4885AHR 598/4885

“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.