SCHEMBL31364072

SCHEMBL31364072

CCCCCCC(C)c1nccc2ccccc12

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.44
NPC1 O15118 5/20 0.44
RAB9A P51151 5/20 0.44
KDM4E B2RXH2 5/20 0.41
KMT2A Q03164 4/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
CYP2A6 P11509 1/20 0.41
MAPT P10636 1/20 0.40
HSD17B10 Q99714 1/20 0.40
NCOA3 Q9Y6Q9 1/20 0.39
ALDH1A1 P00352 4/20 0.39
GAA P10253 4/20 0.39
HTT P42858 4/20 0.39
SMN1; SMN2 Q16637 4/20 0.39
MEN1 O00255 3/20 0.39
NPSR1 Q6W5P4 2/20 0.39
MAPK1 P28482 1/20 0.39
RAD52 P43351 1/20 0.39
CNR1 P21554 3/20 0.39
CNR2 P34972 3/20 0.39

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
SCHEMBL28771178 1.00 LMNA (0.44) LMNANPC1RAB9AKDM4EKMT2A
SCHEMBL19565945 1.00 LMNA (0.44) LMNANPC1RAB9AKDM4EKMT2A
SCHEMBL31364013 0.98 LMNA (0.45) LMNANPC1RAB9AKDM4EKMT2A
SCHEMBL29249930 0.94 LMNA (0.46) LMNANPC1RAB9AKDM4EKMT2A
SCHEMBL29249917 0.88 LMNA (0.49) LMNANPC1RAB9AKMT2ACYP2A6
SCHEMBL28940999 0.85 LMNA (0.46) LMNANPC1RAB9ACYP2A6MAPT
SCHEMBL31364124 0.82 LMNA (0.44) LMNANPC1RAB9AKDM4EKMT2A
SCHEMBL11266782 0.81 LMNA (0.51) LMNANPC1RAB9AKMT2ACYP2A6
SCHEMBL21666378 0.78 GPR84 (0.49) KDM4EKMT2AL3MBTL1MAPTHSD17B10
SCHEMBL31364053 0.78 LMNA (0.45) LMNANPC1RAB9AKDM4EKMT2A

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