SCHEMBL31325838

SCHEMBL31325838

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

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 5/20 0.44
MAOA P21397 3/20 0.44
TDP1 Q9NUW8 4/20 0.39
ALDH1A1 P00352 3/20 0.39
KDM4E B2RXH2 2/20 0.39
CYP3A4 P08684 3/20 0.35
TSHR P16473 2/20 0.35
GFER P55789 1/20 0.35
MAPT P10636 2/20 0.35
L3MBTL1 Q9Y468 2/20 0.35
CYP1A2 P05177 1/20 0.35
CYP2D6 P10635 1/20 0.35
CYP2C9 P11712 1/20 0.35
CYP2C19 P33261 1/20 0.35
DNM1 Q05193 2/20 0.35
LOXL2 Q9Y4K0 1/20 0.34
APOBEC3A P31941 1/20 0.34
APOBEC3G Q9HC16 1/20 0.34
TAAR1 Q96RJ0 1/20 0.34
HSD17B10 Q99714 1/20 0.34

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
SCHEMBL31325837 0.84 ALDH1A1 (0.41) TDP1ALDH1A1KDM4ETSHRMAPT
SCHEMBL31325829 0.82 ACHE (0.41) TDP1ALDH1A1KDM4ECYP3A4TSHR
SCHEMBL31325828 0.80 MAOB (0.45) MAOBMAOATDP1ALDH1A1KDM4E
SCHEMBL12323766 0.79 MAOB (0.48) MAOBMAOATDP1ALDH1A1KDM4E
SCHEMBL31325830 0.79 LTA4H (0.50) TDP1L3MBTL1TAAR1TP53HTT
SCHEMBL5426524 0.78 ALDH1A1 (0.61) TDP1ALDH1A1KDM4ETSHRDNM1
Hydrochloric Acid SCHEMBL11785550 0.76 ALDH1A1 (0.65) TDP1ALDH1A1KDM4ETSHRDNM1
SCHEMBL5436496 0.76 APOBEC3A (0.50) TDP1ALDH1A1KDM4ETSHRDNM1
SCHEMBL12704927 0.75 TDP1 (0.48) MAOBMAOATDP1ALDH1A1KDM4E
SCHEMBL9344086 0.74 LTA4H (0.45) TDP1L3MBTL1SMN1; SMN2RAB9AMEN1

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