SCHEMBL27360925

SCHEMBL27360925

CNCC(C)Nc1ccccc1C

nearest known ligand 0.45

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.45
HTT P42858 1/20 0.45
TAAR1 Q96RJ0 1/20 0.41
SLC6A2 P23975 1/20 0.39
SLC6A4 P31645 1/20 0.39
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
P2RX7 Q99572 1/20 0.38
PGR P06401 1/20 0.37
SCN1A P35498 1/20 0.37
SCN2A Q99250 1/20 0.37
SCN3A Q9NY46 1/20 0.37
HPGD P15428 3/20 0.37
ALDH1A1 P00352 2/20 0.37
LMNA P02545 2/20 0.36
GAA P10253 2/20 0.36
KDM4E B2RXH2 1/20 0.36
TDP1 Q9NUW8 1/20 0.36

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
SCHEMBL24635669 0.85 KEAP1 (0.41) MAPTHTTTAAR1ALDH1A1LMNA
SCHEMBL24635258 0.81 MAPT (0.42) MAPTHTTTAAR1SLC6A2SLC6A4
SCHEMBL14930874 0.80 ALDH1A1 (0.50) MAPTHTTNPC1RAB9AP2RX7
SCHEMBL20780229 0.78 MAPT (0.47) MAPTHTTNPC1RAB9AP2RX7
SCHEMBL24635574 0.78 ALDH1A1 (0.41) MAPTHTTTAAR1SLC6A2SLC6A4
SCHEMBL23774851 0.77 MAPT (0.45) MAPTHTTNPC1RAB9AP2RX7
SCHEMBL11598415 0.76 SIGMAR1 (0.55) TAAR1NPC1RAB9A
SCHEMBL23747256 0.76 MAPT (0.44) MAPTHTTNPC1RAB9AP2RX7
SCHEMBL13626615 0.76 KDM4E (0.48) MAPTHTTNPC1RAB9AP2RX7
SCHEMBL245209 0.74 MAPT (0.50) MAPTHTTNPC1RAB9AP2RX7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024145546-A1 PROCESS FOR SYNTHESIZING 2-BROMOLYSERGIC ACID DIETHYLAMIDE VIA CONTROLLED BROMINATION OF LYSERGIC ACID CERUVIA LIFESCIENCES LLC (US) 2024-07-04 WO disclosed