SCHEMBL4491308

SCHEMBL4491308

CC(=O)N(C)c1ccc(N/C(=C2\C(=O)Nc3cc(F)ccc32)c2cccc(CC(=O)O)c2)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SENP1 Q9P0U3 2/20 0.38
ALOX15 P16050 1/20 0.37
HSD17B10 Q99714 1/20 0.37
BACE1 P56817 1/20 0.37
POLB P06746 2/20 0.36
NPC1 O15118 1/20 0.36
CASP6 P55212 1/20 0.36
TP53 P04637 2/20 0.36
RAB9A P51151 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
TGM2 P21980 1/20 0.35
MAPT P10636 1/20 0.34
ALDH1A1 P00352 1/20 0.34
PDGFRB P09619 2/20 0.34
MEN1 O00255 1/20 0.34
FFAR1 O14842 1/20 0.34
GLA P06280 1/20 0.34
KMT2A Q03164 1/20 0.34
HPSE Q9Y251 1/20 0.34
AURKA O14965 1/20 0.33

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
SCHEMBL4491313 1.00 SENP1 (0.38) SENP1ALOX15HSD17B10BACE1POLB
SCHEMBL228476 0.92 BACE1 (0.38) SENP1ALOX15HSD17B10BACE1POLB
SCHEMBL228475 0.92 BACE1 (0.38) SENP1ALOX15HSD17B10BACE1POLB
SCHEMBL3531620 0.91 SENP1 (0.36) SENP1BACE1TP53TGM2MAPT
SCHEMBL3531618 0.91 SENP1 (0.36) SENP1BACE1TP53TGM2MAPT
SCHEMBL226479 0.91 BACE1 (0.39) ALOX15HSD17B10BACE1POLBNPC1
SCHEMBL226480 0.91 BACE1 (0.39) ALOX15HSD17B10BACE1POLBNPC1
SCHEMBL4484188 0.90 NPC1 (0.40) SENP1ALOX15HSD17B10POLBNPC1
SCHEMBL4484183 0.90 NPC1 (0.40) SENP1ALOX15HSD17B10POLBNPC1
SCHEMBL4482161 0.90 SENP1 (0.35) SENP1BACE1TP53TGM2MAPT

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 4 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
EP-1527046-A1 INDOLINE DERIVATIVES SUBSTITUTED IN POSITION 6, PRODUCTION AND USE THEREOF AS MEDICAMENTS BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2005-05-04 EP disclosed
WO-2004009546-A1 INDOLINE DERIVATIVES SUBSTITUTED IN POSITION 6, PRODUCTION AND USE THEREOF AS MEDICAMENTS BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2004-01-29 WO 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 SENP1 3761/4885ALOX15 2439/4885HSD17B10 2351/4885

“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.