SCHEMBL28490901

SCHEMBL28490901

COc1ccc(CN(Cc2ccc(OC)cc2)c2cccc(C)c2)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.56
RAB9A P51151 2/20 0.56
TSPO P30536 1/20 0.51
ACHE P22303 1/20 0.47
MAPT P10636 3/20 0.46
LMNA P02545 2/20 0.46
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
QPCT Q16769 2/20 0.45
RELA Q04206 1/20 0.45
GAA P10253 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
ALDH1A1 P00352 1/20 0.44
POLB P06746 1/20 0.43
MTNR1A P48039 1/20 0.43
MTNR1B P49286 1/20 0.43
BCL2A1 Q16548 1/20 0.43
MAOB P27338 1/20 0.43
APLNR P35414 1/20 0.42
NR3C1 P04150 1/20 0.42

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
SCHEMBL3979580 0.81 CYP2C19 (0.63) NPC1RAB9ATSPOLMNAMEN1
SCHEMBL26694572 0.81 LTA4H (0.57) ACHEMAPTLMNAMEN1KMT2A
SCHEMBL24455917 0.80 CYP2C19 (0.61) TSPOACHEMAPTLMNAQPCT
SCHEMBL11411386 0.80 TSHR (0.58) NPC1RAB9ALMNAALDH1A1POLB
SCHEMBL11776874 0.80 CYP2C19 (0.61) TSPOACHEMAPTLMNAQPCT
SCHEMBL22340523 0.79 MTNR1A (0.51) MAPTLMNAMEN1KMT2AQPCT
SCHEMBL6233097 0.79 APLNR (0.53) MAPTLMNAQPCTALDH1A1APLNR
SCHEMBL31288437 0.78 TSPO (0.52) NPC1RAB9ATSPOACHEMAPT
SCHEMBL26694464 0.78 TSPO (0.52) NPC1RAB9ATSPOACHEMAPT
SCHEMBL22340862 0.77 MTNR1A (0.55) MAPTLMNAMEN1KMT2AALDH1A1

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
WO-2025049274-A2 TETRACYCLIC DERIVATIVES, COMPOSITIONS AND METHODS THEREOF ENSEM THERAPEUTICS, INC. (US) 2025-03-06 WO disclosed
CN-112119075-B Condensed ring compound 豪夫迈·罗氏有限公司 2024-03-12 CN disclosed
CN-112119075-A Fused ring compound 豪夫迈·罗氏有限公司 2020-12-22 CN disclosed