SCHEMBL7486303

SCHEMBL7486303

CCOC(=O)c1ccc2c(c1)NC(=O)/C2=C(/Nc1ccc(N(CCCNC)S(C)(=O)=O)cc1)c1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RXFP1 Q9HBX9 1/20 0.42
MAPT P10636 6/20 0.40
MEN1 O00255 4/20 0.40
KMT2A Q03164 4/20 0.40
GAA P10253 2/20 0.40
NPSR1 Q6W5P4 2/20 0.40
SMN1; SMN2 Q16637 4/20 0.39
NPC1 O15118 2/20 0.39
RAB9A P51151 2/20 0.39
USP2 O75604 1/20 0.39
LMNA P02545 3/20 0.37
ALDH1A1 P00352 3/20 0.37
MAPK1 P28482 1/20 0.37
CETP P11597 1/20 0.37
SENP1 Q9P0U3 1/20 0.36
EPHX2 P34913 1/20 0.36
CA12 O43570 1/20 0.36
CA9 Q16790 1/20 0.36
CYP1A2 P05177 1/20 0.35
CYP3A4 P08684 1/20 0.35

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
SCHEMBL2570338 1.00 RXFP1 (0.42) RXFP1MAPTMEN1KMT2AGAA
SCHEMBL2570334 1.00 RXFP1 (0.42) RXFP1MAPTMEN1KMT2AGAA
SCHEMBL2572053 0.95 RXFP1 (0.41) RXFP1MAPTMEN1KMT2AGAA
SCHEMBL2572055 0.95 RXFP1 (0.41) RXFP1MAPTMEN1KMT2AGAA
SCHEMBL3156401 0.93 POLB (0.40) RXFP1MAPTMEN1KMT2ANPSR1
SCHEMBL3156414 0.93 POLB (0.40) RXFP1MAPTMEN1KMT2ANPSR1
SCHEMBL2571034 0.92 RXFP1 (0.43) RXFP1MAPTMEN1KMT2AGAA
SCHEMBL2571030 0.92 RXFP1 (0.43) RXFP1MAPTMEN1KMT2AGAA
SCHEMBL3153904 0.90 RXFP1 (0.41) RXFP1MAPTMEN1KMT2AGAA
SCHEMBL3153897 0.90 RXFP1 (0.41) RXFP1MAPTMEN1KMT2AGAA

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
EP-1224170-A1 6-POSITION SUBSTITUTED INDOLINE, PRODUCTION AND USE THEREOF AS A MEDICAMENT Boehringer Ingelheim Pharma KG (DE) 2002-07-24 EP disclosed
WO-2001027081-A1 6-POSITION SUBSTITUTED INDOLINE, PRODUCTION AND USE THEREOF AS A MEDICAMENT BOEHRINGER INGELHEIM PHARMA KG (DE) 2001-04-19 WO disclosed