SCHEMBL31364053

SCHEMBL31364053

CCCCC(CCC)c1nccc2ccccc12

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.45
CYP2A6 P11509 1/20 0.42
MAPT P10636 1/20 0.40
HSD17B10 Q99714 1/20 0.40
NPC1 O15118 2/20 0.39
RAB9A P51151 2/20 0.39
F12 P00748 1/20 0.39
PLAU P00749 1/20 0.39
NCF1 P14598 1/20 0.39
NOS3 P29474 1/20 0.39
NOS1 P29475 1/20 0.39
NOS2 P35228 1/20 0.39
BACE1 P56817 1/20 0.39
NCOA3 Q9Y6Q9 1/20 0.37
UTS2R Q9UKP6 1/20 0.35
GAA P10253 2/20 0.35
TDP1 Q9NUW8 2/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
HTR1B P28222 1/20 0.35
KDM4E B2RXH2 1/20 0.35

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
SCHEMBL31364005 0.94 LMNA (0.50) LMNACYP2A6MAPTHSD17B10NPC1
SCHEMBL31364017 0.91 LMNA (0.45) LMNACYP2A6MAPTHSD17B10NPC1
SCHEMBL29249921 0.88 LMNA (0.47) LMNACYP2A6MAPTHSD17B10NPC1
SCHEMBL31364124 0.87 LMNA (0.44) LMNACYP2A6MAPTHSD17B10NPC1
SCHEMBL29249930 0.83 LMNA (0.46) LMNACYP2A6MAPTHSD17B10NPC1
SCHEMBL27550599 0.82 LMNA (0.45) LMNACYP2A6MAPTHSD17B10NPC1
SCHEMBL1619599 0.81 LMNA (0.55) LMNACYP2A6MAPTHSD17B10NPC1
SCHEMBL29492646 0.80 LMNA (0.53) LMNACYP2A6MAPTHSD17B10NPC1
SCHEMBL11270418 0.80 LMNA (0.53) LMNACYP2A6MAPTHSD17B10NPC1
SCHEMBL29249917 0.80 LMNA (0.49) LMNACYP2A6MAPTHSD17B10NPC1

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
CN-119638622-A Photocatalytic alkane C (sp)3) Method for activating H bond and constructing C-C bond with aza arene 中国科学院理化技术研究所 2025-03-18 CN disclosed