SCHEMBL4487849

SCHEMBL4487849

NCc1ccc(N/C(=C2\C(=O)Nc3cc(Cl)ccc32)c2cccc(CC(=O)O)c2)cc1

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NR1H4 Q96RI1 2/20 0.40
KLKB1 P03952 1/20 0.39
RXFP1 Q9HBX9 1/20 0.39
KDM4E B2RXH2 2/20 0.38
MAPT P10636 1/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
ALDH1A1 P00352 2/20 0.38
FFAR1 O14842 1/20 0.37
TP53 P04637 1/20 0.37
GLA P06280 1/20 0.37
HPSE Q9Y251 1/20 0.37
AKT2 P31751 1/20 0.36
AGBL2 Q5U5Z8 1/20 0.36
KDR P35968 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
SCHEMBL4487853 1.00 NR1H4 (0.40) NR1H4KLKB1RXFP1KDM4EMAPT
SCHEMBL4485914 0.92 KDM4E (0.42) NR1H4KLKB1KDM4EMAPTMEN1
SCHEMBL4485917 0.92 KDM4E (0.42) NR1H4KLKB1KDM4EMAPTMEN1
SCHEMBL223622 0.91 FFAR1 (0.40) KLKB1RXFP1FFAR1
SCHEMBL223623 0.91 FFAR1 (0.40) KLKB1RXFP1FFAR1
SCHEMBL4500950 0.90 NR1H4 (0.39) NR1H4RXFP1KDM4EMAPTMEN1
SCHEMBL4488874 0.90 NR1H4 (0.40) NR1H4RXFP1KDM4EMAPTMEN1
SCHEMBL4500945 0.90 NR1H4 (0.39) NR1H4RXFP1KDM4EMAPTMEN1
SCHEMBL4488877 0.89 ROCK2 (0.41) NR1H4KLKB1RXFP1KDM4EMAPT
SCHEMBL4488882 0.89 ROCK2 (0.41) NR1H4KLKB1RXFP1KDM4EMAPT

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 NR1H4 544/4885KLKB1 2581/4885RXFP1 425/4885

“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.