SCHEMBL29198532

SCHEMBL29198532

CCCCCCCC(C)[n+]1ccc(C)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.53
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
TP53 P04637 1/20 0.37
CYP1A2 P05177 1/20 0.37
CYP2D6 P10635 1/20 0.37
MAPT P10636 1/20 0.37
CYP2C9 P11712 1/20 0.37
CYP2C19 P33261 1/20 0.37
LMNA P02545 2/20 0.36
KDM4E B2RXH2 1/20 0.36
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
OPRM1 P35372 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.33
SPHK1 Q9NYA1 1/20 0.33
ALDH1A1 P00352 1/20 0.32
MCHR1 Q99705 1/20 0.32

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
SCHEMBL28251928 1.00 HTT (0.53) HTTMEN1KMT2ATP53CYP1A2
SCHEMBL29198466 1.00 HTT (0.53) HTTMEN1KMT2ATP53CYP1A2
SCHEMBL28228298 0.93 HTT (0.47) HTTMEN1KMT2ATP53CYP1A2
SCHEMBL13621693 0.81 HTT (0.52) HTTMEN1KMT2ATP53CYP1A2
Hydrochloric Acid SCHEMBL9837393 0.80 CHKA (0.43) HTTMEN1KMT2ATP53CYP1A2
SCHEMBL12218260 0.80 KMT2A (0.68) HTTMEN1KMT2ATP53CYP1A2
SCHEMBL28252515 0.80 HTT (0.40) HTTMEN1KMT2AMAPTLMNA
SCHEMBL29260812 0.80 HTT (0.40) HTTMEN1KMT2AMAPTLMNA
SCHEMBL1168955 0.79 CHRM2 (0.47) HTTMEN1KMT2AMAPTLMNA
SCHEMBL2563316 0.79 CHRM2 (0.47) HTTMEN1KMT2AMAPTLMNA

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-113382860-B Adhesive sheet and use thereof 日东电工株式会社 2024-03-22 CN disclosed