SCHEMBL31325832

SCHEMBL31325832

CC[N+](CC)(Cc1ccc(C)cc1)c1ccccc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.39
POLB P06746 1/20 0.39
TDP1 Q9NUW8 2/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
KDM4E B2RXH2 1/20 0.38
ALDH1A1 P00352 1/20 0.38
ACHE P22303 2/20 0.37
TSHR P16473 1/20 0.37
ALOX12 P18054 1/20 0.37
SMN1; SMN2 Q16637 3/20 0.37
DNM1 Q05193 2/20 0.37
HTT P42858 3/20 0.36
CYP2C19 P33261 1/20 0.36
MEN1 O00255 3/20 0.36
KMT2A Q03164 3/20 0.36
TP53 P04637 1/20 0.36
MAPK1 P28482 1/20 0.36
IDO1 P14902 1/20 0.35
KCNH2 Q12809 1/20 0.35
BCHE P06276 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
Hydrochloric Acid SCHEMBL11423658 0.91 KDM4E (0.45) LMNAPOLBTDP1L3MBTL1KDM4E
SCHEMBL28385299 0.88 KDM4E (0.48) TDP1KDM4EALDH1A1SMN1; SMN2DNM1
Water SCHEMBL9686085 0.86 KDM4E (0.46) TDP1KDM4EALDH1A1SMN1; SMN2DNM1
Bromide SCHEMBL11785608 0.86 DNM1 (0.47) TDP1KDM4EALDH1A1ACHESMN1; SMN2
Hydrochloric Acid SCHEMBL11245196 0.86 KDM4E (0.52) TDP1KDM4EALDH1A1SMN1; SMN2DNM1
Fluoride SCHEMBL28344210 0.86 KDM4E (0.46) TDP1KDM4EALDH1A1SMN1; SMN2DNM1
Fluoride Ion SCHEMBL5371566 0.84 KDM4E (0.45) TDP1KDM4EALDH1A1ACHESMN1; SMN2
Fluoride Ion SCHEMBL8153065 0.84 KDM4E (0.45) TDP1KDM4EALDH1A1ACHESMN1; SMN2
Fluoride Ion SCHEMBL8153068 0.84 KDM4E (0.45) TDP1KDM4EALDH1A1ACHESMN1; SMN2
SCHEMBL31325828 0.83 MAOB (0.45) TDP1L3MBTL1KDM4EALDH1A1TSHR

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-2025018368-A1 ADHESIVE COMPOSITION, ADHESIVE FILM FOR CIRCUIT CONNECTION, CONNECTED STRUCTURE, AND METHOD FOR PRODUCING CONNECTED STRUCTURE 株式会社レゾナック 2025-01-23 WO disclosed