SCHEMBL6135848

SCHEMBL6135848

Cc1cc2cccc(COc3cc[c]cc3)c2[nH]1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 7/20 0.35
HSD17B10 Q99714 4/20 0.35
HPGD P15428 3/20 0.35
L3MBTL1 Q9Y468 2/20 0.35
ATM Q13315 2/20 0.35
GYS1 P13807 3/20 0.35
DAO P14920 1/20 0.35
ALDH1A1 P00352 5/20 0.33
PIK3CD O00329 2/20 0.33
LMNA P02545 1/20 0.33
RXFP1 Q9HBX9 1/20 0.33
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
AXL P30530 1/20 0.33
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
PARP10 Q53GL7 1/20 0.32
TSHR P16473 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
FLT3 P36888 1/20 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
SCHEMBL6135945 0.78 DAO (0.37) KDM4EHSD17B10HPGDDAOALDH1A1
SCHEMBL5673146 0.72 DAO (0.60) KDM4EHSD17B10HPGDDAOALDH1A1
SCHEMBL11419601 0.71 MAOB (0.43) KDM4EKMT2AMAOB
SCHEMBL4050754 0.71 PARP10 (0.57) LMNAMEN1KMT2ANPC1RAB9A
SCHEMBL920482 0.71 MAOB (0.57) KDM4EKMT2AMAOB
SCHEMBL5761409 0.70 L3MBTL1 (0.45) KDM4EHSD17B10HPGDL3MBTL1ALDH1A1
SCHEMBL4053035 0.67 FFAR1 (0.48) MEN1KMT2AMAOB
SCHEMBL697645 0.65 IDO1 (0.53) KDM4EALDH1A1MEN1KMT2ANPC1
SCHEMBL3969062 0.65 TAAR1 (0.42) KDM4EHPGDL3MBTL1ALDH1A1NPC1
SCHEMBL17514826 0.65 MAOB (0.49) NPC1RAB9APARP10TSHRMAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1546109-A4 HYDANTOIN DERIVATIVES AS INHIBITORS OF MATRIX METALLOPROTEINASES AND/OR TNF-ALPHA CONVERTING ENZYME (TACE) BRISTOL MYERS SQUIBB CO (US) 2005-11-09 EP disclosed
EP-1546109-A2 HYDANTOIN DERIVATIVES AS INHIBITORS OF MATRIX METALLOPROTEINASES AND/OR TNF-ALPHA CONVERTING ENZYME (TACE) Bristol-Myers Squibb Company (US) 2005-06-29 EP disclosed
WO-2004033632-A2 HYDANTOIN DERIVATIVES AS INHIBITORS OF MATRIX METALLOPROTEINASES AND/OR TNF-ALPHA CONVERTING ENZYME (TACE) BRISTOL-MYERS SQUIBB COMPANY (US) 2004-04-22 WO disclosed