SCHEMBL31325834

SCHEMBL31325834

CCc1ccc(C[N+](C)(C)c2ccccc2)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 2/20 0.52
ALDH1A1 P00352 2/20 0.45
KDM4E B2RXH2 2/20 0.45
TDP1 Q9NUW8 1/20 0.45
KIF11 P52732 1/20 0.40
APOBEC3A P31941 1/20 0.39
APOBEC3G Q9HC16 1/20 0.39
DNM1 Q05193 2/20 0.39
ACHE P22303 1/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
MAPK1 P28482 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP2A6 P11509 1/20 0.38
HTT P42858 2/20 0.37
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
CRHBP P24387 1/20 0.36
CRHR2 Q13324 1/20 0.36

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
SCHEMBL565108 0.87 KDM4E (0.58) TP53ALDH1A1KDM4ETDP1APOBEC3A
Hydrochloric Acid SCHEMBL28191207 0.85 KDM4E (0.56) TP53ALDH1A1KDM4ETDP1APOBEC3A
Hydrochloric Acid SCHEMBL1559083 0.85 KDM4E (0.62) TP53ALDH1A1KDM4ETDP1APOBEC3A
Water SCHEMBL28001864 0.85 KDM4E (0.56) TP53ALDH1A1KDM4ETDP1APOBEC3A
Bromide SCHEMBL6122965 0.85 KDM4E (0.56) TP53ALDH1A1KDM4ETDP1APOBEC3A
Water SCHEMBL9684775 0.85 KDM4E (0.56) TP53ALDH1A1KDM4ETDP1APOBEC3A
Ammonia Solution, Strong SCHEMBL28850907 0.85 KDM4E (0.56) TP53ALDH1A1KDM4ETDP1APOBEC3A
SCHEMBL21747552 0.85 KDM4E (0.56) TP53ALDH1A1KDM4ETDP1APOBEC3A
Iodide SCHEMBL22188504 0.85 KDM4E (0.56) TP53ALDH1A1KDM4ETDP1APOBEC3A
Fluoride SCHEMBL28344247 0.85 KDM4E (0.56) TP53ALDH1A1KDM4ETDP1APOBEC3A

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