SCHEMBL4494407

SCHEMBL4494407

NC(CCO)(CCO)c1ccc(NC(=C2C(=O)Nc3cc(F)ccc32)c2ccccc2)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 2/20 0.41
TP53 P04637 1/20 0.36
MAPT P10636 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
RXFP1 Q9HBX9 1/20 0.36
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
AURKB Q96GD4 3/20 0.34
KDR P35968 2/20 0.34
AURKA O14965 1/20 0.34
PDGFRB P09619 1/20 0.34
PDGFRA P16234 1/20 0.34
FLT3 P36888 1/20 0.34
AURKC Q9UQB9 1/20 0.34
CASP3 P42574 3/20 0.33
CA12 O43570 1/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
CA9 Q16790 1/20 0.33
HDAC3 O15379 2/20 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
SCHEMBL4494396 1.00 BACE1 (0.41) BACE1TP53MAPTSMN1; SMN2RXFP1
SCHEMBL4496148 0.90 BACE1 (0.41) BACE1TP53MAPTSMN1; SMN2RXFP1
SCHEMBL4496034 0.89 CES1 (0.35) BACE1RXFP1NPC1RAB9AAURKB
SCHEMBL2567164 0.89 BACE1 (0.39) BACE1TP53MAPTSMN1; SMN2RXFP1
SCHEMBL2567153 0.89 BACE1 (0.39) BACE1TP53MAPTSMN1; SMN2RXFP1
SCHEMBL4496024 0.89 CES1 (0.35) BACE1RXFP1NPC1RAB9AAURKB
SCHEMBL4504086 0.87 BACE1 (0.44) BACE1TP53MAPTSMN1; SMN2RXFP1
SCHEMBL4496147 0.84 BACE1 (0.49) BACE1TP53MAPTSMN1; SMN2RXFP1
SCHEMBL4496144 0.84 BACE1 (0.49) BACE1TP53MAPTSMN1; SMN2RXFP1
SCHEMBL4492728 0.83 BACE1 (0.40) BACE1TP53MAPTSMN1; SMN2RXFP1

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 1615/4885TP53 681/4885MAPT 545/4885

“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.