SCHEMBL4492354

SCHEMBL4492354

CN1CCCN(CC(=O)N(C)c2ccc(NC(=C3C(=O)Nc4cc(Cl)ccc43)c3ccccc3)cc2)CC1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AAK1 Q2M2I8 1/20 0.44
DRD4 P21917 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
PIM1 P11309 3/20 0.41
PIM2 Q9P1W9 3/20 0.41
ABL1 P00519 1/20 0.40
NTRK1 P04629 1/20 0.40
CSF1R P07333 1/20 0.40
RET P07949 1/20 0.40
PDGFRB P09619 1/20 0.40
KIT P10721 1/20 0.40
FGFR1 P11362 1/20 0.40
PDGFRA P16234 1/20 0.40
FLT1 P17948 1/20 0.40
FGFR2 P21802 1/20 0.40
FGFR4 P22455 1/20 0.40
FGFR3 P22607 1/20 0.40
FLT4 P35916 1/20 0.40
KDR P35968 1/20 0.40
NTRK3 Q16288 1/20 0.40

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
SCHEMBL4492351 1.00 AAK1 (0.44) AAK1DRD4SMN1; SMN2PIM1PIM2
SCHEMBL4485414 0.97 AAK1 (0.46) AAK1DRD4SMN1; SMN2PIM1PIM2
SCHEMBL4485411 0.97 AAK1 (0.46) AAK1DRD4SMN1; SMN2PIM1PIM2
SCHEMBL4489305 0.94 DRD4 (0.43) AAK1DRD4SMN1; SMN2ABL1NTRK1
SCHEMBL4489310 0.94 DRD4 (0.43) AAK1DRD4SMN1; SMN2ABL1NTRK1
SCHEMBL4490929 0.93 DRD4 (0.43) AAK1DRD4SMN1; SMN2TACR1
SCHEMBL4490925 0.93 DRD4 (0.43) AAK1DRD4SMN1; SMN2TACR1
SCHEMBL4497678 0.93 PDGFRB (0.44) AAK1DRD4SMN1; SMN2PIM1PIM2
SCHEMBL4497681 0.93 PDGFRB (0.44) AAK1DRD4SMN1; SMN2PIM1PIM2
SCHEMBL226539 0.92 AAK1 (0.44) AAK1DRD4SMN1; SMN2ABL1NTRK1

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 AAK1 1080/4885DRD4 1051/4885SMN1; SMN2 4006/4885

“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.