SCHEMBL6052307

SCHEMBL6052307

Cc1nn(-c2ccc(F)cc2)c(C)c1C(=O)Nc1ccc(N2CCN(CCO)CC2)c(C#N)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.46
RXFP1 Q9HBX9 4/20 0.45
MEN1 O00255 3/20 0.45
ALDH1A1 P00352 3/20 0.45
KMT2A Q03164 3/20 0.45
HPGD P15428 2/20 0.45
HSD17B10 Q99714 2/20 0.45
NPSR1 Q6W5P4 2/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
TP53 P04637 4/20 0.43
POLB P06746 1/20 0.43
AR P10275 1/20 0.42
USP2 O75604 1/20 0.42
ALOX15 P16050 1/20 0.42
LMNA P02545 1/20 0.41
GAA P10253 1/20 0.41
CHRM5 P08912 1/20 0.41
CHRM1 P11229 1/20 0.41
CHRM3 P20309 1/20 0.41
DRD4 P21917 1/20 0.41

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
SCHEMBL7055222 0.87 ALDH1A1 (0.41) MAPTRXFP1MEN1ALDH1A1KMT2A
SCHEMBL6052277 0.86 NPC1 (0.47) MAPTRXFP1MEN1ALDH1A1KMT2A
SCHEMBL6052213 0.84 ALDH1A1 (0.45) MAPTRXFP1MEN1ALDH1A1KMT2A
Water SCHEMBL6052368 0.83 TRPV4 (0.45) MAPTRXFP1MEN1ALDH1A1KMT2A
SCHEMBL6052333 0.83 TRPV4 (0.45) MAPTRXFP1MEN1ALDH1A1KMT2A
SCHEMBL6052116 0.81 NPC1 (0.46) MAPTRXFP1MEN1ALDH1A1KMT2A
Hydrochloric Acid SCHEMBL6052329 0.81 NPC1 (0.45) MAPTRXFP1MEN1ALDH1A1KMT2A
SCHEMBL7051428 0.79 ALDH1A1 (0.41) MAPTRXFP1MEN1ALDH1A1KMT2A
Water SCHEMBL6052541 0.79 NPC1 (0.45) MAPTRXFP1MEN1ALDH1A1KMT2A
SCHEMBL6052359 0.79 RXFP1 (0.48) MAPTRXFP1MEN1ALDH1A1KMT2A

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1176140-B1 AMIDE COMPOUNDS AND MEDICINAL USE THEREOF MITSUBISHI PHARMA CORP (JP) 2004-12-29 EP claimed
CN-1346348-A Amide compound and pharmaceutical use thereof YOSHITOMI PHARMACEUTICAL (JP) 2002-04-24 CN claimed
EP-1176140-A1 AMIDE COMPOUNDS AND MEDICINAL USE THEREOF Mitsubishi Pharma Corporation (JP) 2002-01-30 EP claimed
US-7015218-B1 Amide compounds and medicinal use thereof MITSUBISHI PHARMA CORPORATION (JP) 2006-03-21 US disclosed
EP-1176140-B1 AMIDE COMPOUNDS AND MEDICINAL USE THEREOF MITSUBISHI PHARMA CORP (JP) 2004-12-29 EP disclosed
EP-1176140-A1 AMIDE COMPOUNDS AND MEDICINAL USE THEREOF Mitsubishi Pharma Corporation (JP) 2002-01-30 EP disclosed