SCHEMBL5859783

SCHEMBL5859783

CCCS(=O)(=O)N(CCN(C)C)c1ccc(NC(=C2C(=O)Nc3cc(Cl)ccc32)c2ccncc2)cc1

nearest known ligand 0.32

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.32
HTT P42858 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
BACE1 P56817 1/20 0.32
NAMPT P43490 2/20 0.31
CES1 P23141 1/20 0.31
ALDH1A1 P00352 1/20 0.31
PLK1 P53350 3/20 0.31
CSF1R P07333 3/20 0.31
TGM2 P21980 1/20 0.30
GAA P10253 1/20 0.30
PDGFRB P09619 1/20 0.30
KIT P10721 1/20 0.30
FGFR1 P11362 1/20 0.30
KDR P35968 1/20 0.30
FLT3 P36888 1/20 0.30
PLK3 Q9H4B4 1/20 0.30
MAPK1 P28482 1/20 0.30

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
SCHEMBL3939872 1.00 LMNA (0.32) LMNAHTTSMN1; SMN2BACE1NAMPT
SCHEMBL4495336 0.92 NPSR1 (0.33) LMNAHTTSMN1; SMN2CES1ALDH1A1
SCHEMBL4495343 0.92 NPSR1 (0.33) LMNAHTTSMN1; SMN2CES1ALDH1A1
SCHEMBL4487192 0.88 CPT1A (0.35)
SCHEMBL4487188 0.88 CPT1A (0.35)
SCHEMBL4488048 0.88 CES1 (0.34) LMNAHTTSMN1; SMN2CES1ALDH1A1
SCHEMBL4488044 0.88 CES1 (0.34) LMNAHTTSMN1; SMN2CES1ALDH1A1
SCHEMBL4484556 0.88 PLK1 (0.33) SMN1; SMN2CES1ALDH1A1PLK1
SCHEMBL4484551 0.88 PLK1 (0.33) SMN1; SMN2CES1ALDH1A1PLK1
SCHEMBL227247 0.87 CPT1A (0.33) PLK1

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-7148249-B2 Indolinones substituted by heterocycles, the preparation thereof and their use as medicaments BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2006-12-12 US disclosed
US-20050054710-A1 Indolinones substituted by heterocycles, the preparation thereof and their use as medicaments BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2005-03-10 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-20050054710-A1 Indolinones substituted by heterocycles, the preparation thereof and their use as medicaments CDK1, CDK2, CDK3 LMNA 1567/4885HTT 4263/4885SMN1; SMN2 4299/4885

“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.