SCHEMBL4492745

SCHEMBL4492745

CN(C)CCN(C(=O)c1ccncc1)c1ccc(NC(=C2C(=O)Nc3cc(Cl)ccc32)c2ccccc2)cc1

nearest known ligand 0.37

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 1/20 0.37
TGM2 P21980 2/20 0.36
LIMK1 P53667 1/20 0.36
ACHE P22303 1/20 0.35
KDM4E B2RXH2 1/20 0.34
KMT2A Q03164 1/20 0.34
NAMPT P43490 2/20 0.34
ALDH1A1 P00352 2/20 0.33
ADRB2 P07550 1/20 0.33
ROCK2 O75116 1/20 0.33
PLK1 P53350 1/20 0.33
PDPK1 O15530 1/20 0.33
HPGD P15428 1/20 0.33
MAPT P10636 1/20 0.33
MCL1 Q07820 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
PTGIR P43119 1/20 0.33
MAPK1 P28482 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
SCHEMBL4492743 1.00 BACE1 (0.37) BACE1TGM2LIMK1ACHEKDM4E
SCHEMBL4491350 0.95 LIMK1 (0.37) LIMK1KDM4EALDH1A1ADRB2PLK1
SCHEMBL4491348 0.95 LIMK1 (0.37) LIMK1KDM4EALDH1A1ADRB2PLK1
SCHEMBL4493501 0.92 TGM2 (0.44) TGM2LIMK1KDM4EKMT2AALDH1A1
SCHEMBL4493504 0.92 TGM2 (0.44) TGM2LIMK1KDM4EKMT2AALDH1A1
SCHEMBL4495018 0.91 BACE1 (0.37) BACE1ACHEKDM4EKMT2ANAMPT
SCHEMBL4495013 0.91 BACE1 (0.37) BACE1ACHEKDM4EKMT2ANAMPT
SCHEMBL4491553 0.88 LIMK1 (0.37) TGM2LIMK1KDM4EALDH1A1PLK1
SCHEMBL4491548 0.88 LIMK1 (0.37) TGM2LIMK1KDM4EALDH1A1PLK1
SCHEMBL4488264 0.87 KDM4E (0.36) LIMK1KDM4EKMT2AALDH1A1PLK1

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 BACE1 1615/4885TGM2 4379/4885LIMK1 312/4885

“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.