SCHEMBL4488720

SCHEMBL4488720

CN(C(=O)CN1CCN(CCN)CC1)c1ccc(NC(=C2C(=O)Nc3cc(Cl)ccc32)c2ccccc2)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD4 P21917 1/20 0.42
AAK1 Q2M2I8 1/20 0.40
TACR1 P25103 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
MAPT P10636 3/20 0.37
ALDH1A1 P00352 1/20 0.37
GFER P55789 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
ABL1 P00519 1/20 0.36
NTRK1 P04629 1/20 0.36
CSF1R P07333 1/20 0.36
RET P07949 1/20 0.36
PDGFRB P09619 1/20 0.36
KIT P10721 1/20 0.36
FGFR1 P11362 1/20 0.36
PDGFRA P16234 1/20 0.36
FLT1 P17948 1/20 0.36
FGFR2 P21802 1/20 0.36
FGFR4 P22455 1/20 0.36
FGFR3 P22607 1/20 0.36

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
SCHEMBL4488712 1.00 DRD4 (0.42) DRD4AAK1TACR1SMN1; SMN2MAPT
SCHEMBL4497711 0.93 DRD4 (0.45) DRD4AAK1TACR1SMN1; SMN2MAPT
SCHEMBL4500612 0.93 DRD4 (0.43) DRD4AAK1TACR1SMN1; SMN2MAPT
SCHEMBL4500609 0.93 DRD4 (0.43) DRD4AAK1TACR1SMN1; SMN2MAPT
SCHEMBL4497708 0.93 DRD4 (0.45) DRD4AAK1TACR1SMN1; SMN2MAPT
SCHEMBL4485411 0.93 AAK1 (0.46) DRD4AAK1TACR1SMN1; SMN2MAPT
SCHEMBL4485414 0.93 AAK1 (0.46) DRD4AAK1TACR1SMN1; SMN2MAPT
SCHEMBL4496476 0.92 DRD4 (0.42) DRD4AAK1TACR1SMN1; SMN2MAPT
SCHEMBL4496485 0.92 DRD4 (0.42) DRD4AAK1TACR1SMN1; SMN2MAPT
SCHEMBL4499293 0.92 DRD4 (0.42) DRD4AAK1TACR1SMN1; SMN2MAPT

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 1051/4885AAK1 1080/4885TACR1 497/4885

“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.