SCHEMBL24499495

SCHEMBL24499495

O=C(CBr)NCc1cccc(Br)c1

nearest known ligand 0.61

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.61
MAPT P10636 2/20 0.57
ALOX5 P09917 1/20 0.52
MTOR P42345 1/20 0.51
F10 P00742 1/20 0.51
F7 P08709 1/20 0.51
TP53 P04637 1/20 0.50
LMNA P02545 3/20 0.49
CYP2C9 P11712 1/20 0.49
CYP2C19 P33261 1/20 0.49
HPGD P15428 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
FFAR1 O14842 1/20 0.48
FFAR4 Q5NUL3 1/20 0.48
AOC3 Q16853 1/20 0.46

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
SCHEMBL6290206 0.86 NPC1 (0.61) NPC1MAPTALOX5MTORF10
SCHEMBL6290205 0.86 NPC1 (0.61) NPC1MAPTALOX5MTORF10
SCHEMBL30259901 0.85 NPC1 (0.59) NPC1MAPTALOX5MTORF10
SCHEMBL17570500 0.85 AOC3 (0.65) NPC1MAPTALOX5MTORF10
SCHEMBL4075832 0.85 GAA (0.64) NPC1MAPTALOX5MTORLMNA
SCHEMBL8480688 0.83 PKM (0.53) MAPTLMNAAOC3
SCHEMBL29625240 0.83 NPC1 (0.61) NPC1F7HPGDL3MBTL1
SCHEMBL24499496 0.83 NPC1 (0.61) NPC1F7HPGDL3MBTL1
SCHEMBL1750050 0.82 CYP1A2 (0.58) NPC1MAPTALOX5MTORF10
SCHEMBL10320867 0.82 F10 (0.57) NPC1MAPTALOX5MTORF10

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
CN-116963733-A Imidazole compounds as ENPP1 inhibitors 斯汀格瑞治疗股份有限公司 2023-10-27 CN disclosed
EP-4255425-A1 IMIDAZOLE COMPOUNDS AS INHIBITORS OF ENPP1 Stingray Therapeutics, Inc. (US) 2023-10-11 EP disclosed
WO-2022119928-A1 IMIDAZOLE COMPOUNDS AS INHIBITORS OF ENPP1 Stingray Therapeutics, Inc. (US) 2022-06-09 WO disclosed
WO-2022119928-A1 IMIDAZOLE COMPOUNDS AS INHIBITORS OF ENPP1 Stingray Therapeutics, Inc. (US) 2022-06-09 WO disclosed