SCHEMBL31364124

SCHEMBL31364124

CCCCCC(CC)c1nccc2ccccc12

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.44
CYP2A6 P11509 1/20 0.41
MAPT P10636 1/20 0.40
HSD17B10 Q99714 1/20 0.40
NPC1 O15118 4/20 0.39
RAB9A P51151 4/20 0.39
F12 P00748 1/20 0.38
PLAU P00749 1/20 0.38
NCF1 P14598 1/20 0.38
NOS3 P29474 1/20 0.38
NOS1 P29475 1/20 0.38
NOS2 P35228 1/20 0.38
BACE1 P56817 1/20 0.38
KDM4E B2RXH2 4/20 0.37
KMT2A Q03164 4/20 0.37
MEN1 O00255 3/20 0.37
ALDH1A1 P00352 3/20 0.37
GAA P10253 3/20 0.37
HTT P42858 3/20 0.37
SMN1; SMN2 Q16637 3/20 0.37

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
SCHEMBL31364017 0.95 LMNA (0.45) LMNACYP2A6MAPTHSD17B10NPC1
SCHEMBL29249921 0.89 LMNA (0.47) LMNACYP2A6MAPTHSD17B10NPC1
SCHEMBL31364053 0.87 LMNA (0.45) LMNACYP2A6MAPTHSD17B10NPC1
SCHEMBL29492646 0.86 LMNA (0.53) LMNACYP2A6MAPTHSD17B10NPC1
SCHEMBL11270418 0.86 LMNA (0.53) LMNACYP2A6MAPTHSD17B10NPC1
SCHEMBL31364013 0.84 LMNA (0.45) LMNACYP2A6MAPTHSD17B10NPC1
SCHEMBL31364005 0.83 LMNA (0.50) LMNACYP2A6MAPTHSD17B10NPC1
SCHEMBL19565945 0.82 LMNA (0.44) LMNACYP2A6MAPTHSD17B10NPC1
SCHEMBL31364072 0.82 LMNA (0.44) LMNACYP2A6MAPTHSD17B10NPC1
SCHEMBL28771178 0.82 LMNA (0.44) 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