SCHEMBL4489305

SCHEMBL4489305

CN(C(=O)CN1CCCC1)c1ccc(N/C(=C2\C(=O)Nc3cc(Cl)ccc32)c2ccccc2)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD4 P21917 1/20 0.43
ALDH1A1 P00352 3/20 0.40
KDM4E B2RXH2 2/20 0.40
LMNA P02545 1/20 0.40
POLB P06746 1/20 0.40
AAK1 Q2M2I8 1/20 0.39
MAPT P10636 3/20 0.38
GFER P55789 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
MCL1 Q07820 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
TACR1 P25103 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
ACHE P22303 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
NAMPT P43490 1/20 0.36
AHCY P23526 1/20 0.36
OPRK1 P41145 1/20 0.35
NPC1 O15118 1/20 0.35

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
SCHEMBL4489310 1.00 DRD4 (0.43) DRD4ALDH1A1KDM4ELMNAPOLB
SCHEMBL4490929 0.99 DRD4 (0.43) DRD4ALDH1A1KDM4ELMNAPOLB
SCHEMBL4490925 0.99 DRD4 (0.43) DRD4ALDH1A1KDM4ELMNAPOLB
SCHEMBL4482689 0.94 DRD4 (0.40) DRD4ALDH1A1KDM4ELMNAPOLB
SCHEMBL4492354 0.94 AAK1 (0.44) DRD4AAK1TACR1SMN1; SMN2ABL1
SCHEMBL4482686 0.94 DRD4 (0.40) DRD4ALDH1A1KDM4ELMNAPOLB
SCHEMBL4492351 0.94 AAK1 (0.44) DRD4AAK1TACR1SMN1; SMN2ABL1
SCHEMBL4485414 0.94 AAK1 (0.46) DRD4ALDH1A1AAK1MAPTGFER
SCHEMBL4505574 0.94 DRD4 (0.44) DRD4ALDH1A1LMNAPOLBAAK1
SCHEMBL4498230 0.94 DRD4 (0.42) DRD4ALDH1A1KDM4ELMNAPOLB

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 DRD4 1051/4885ALDH1A1 2036/4885KDM4E 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.