SCHEMBL29068464

SCHEMBL29068464

CCN(c1ccc(C)cc1)c1ccc2c(c1)-c1ccc(NCCc3ccccc3)cc1C2

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR3C2 P08235 1/20 0.37
RAB9A P51151 2/20 0.36
NPC1 O15118 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.35
MAPT P10636 3/20 0.35
CYP1A2 P05177 3/20 0.34
HSD17B10 Q99714 2/20 0.34
CYP3A4 P08684 2/20 0.34
CYP2D6 P10635 1/20 0.34
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 1/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
CTDSP1 Q9GZU7 1/20 0.34
HPGD P15428 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
HTT P42858 1/20 0.34
ADRA2A P08913 1/20 0.34
MAOA P21397 1/20 0.34
SLC6A2 P23975 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
SCHEMBL29068519 0.89 HTT (0.47) NR3C2RAB9ANPC1MAPTCYP1A2
SCHEMBL27633770 0.84 HPGD (0.42) NR3C2RAB9ANPC1L3MBTL1MAPT
SCHEMBL29068461 0.79 HTT (0.40) RAB9ANPC1MAPTCYP1A2HSD17B10
SCHEMBL30572819 0.79 HTT (0.40) RAB9ANPC1MAPTCYP1A2HSD17B10
SCHEMBL25436138 0.78 METAP1 (0.37) NR3C2RAB9ANPC1L3MBTL1MAPT
SCHEMBL7868915 0.77 CNR2 (0.45) RAB9ANPC1MAPTCYP1A2HSD17B10
SCHEMBL29068489 0.76 HTT (0.49) RAB9ANPC1L3MBTL1MAPTCYP1A2
SCHEMBL29068483 0.75 METAP1 (0.39) NR3C2L3MBTL1MAPTCYP1A2HSD17B10
SCHEMBL6429534 0.74 NR3C2 (0.37) NR3C2RAB9ANPC1MAPTCYP1A2
SCHEMBL29068537 0.74 RAB9A (0.46) RAB9ANPC1L3MBTL1MAPTCYP1A2

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-116745115-A Laminate, card and case 索尼集团公司 2023-09-12 CN disclosed