SCHEMBL11833911

SCHEMBL11833911

CCC(=O)OC(C)CN(CC)c1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ SCN1A P35498 1/20 0.43
▸ SCN2A Q99250 1/20 0.43
▸ SCN3A Q9NY46 1/20 0.43
▸ CNR2 P34972 5/20 0.43
▸ HSD11B1 P28845 1/20 0.43
▸ MEN1 O00255 3/20 0.42
▸ KMT2A Q03164 3/20 0.42
▸ NPC1 O15118 1/20 0.42
▸ RAB9A P51151 1/20 0.42
▸ NOX1 Q9Y5S8 1/20 0.42
▸ TSHR P16473 4/20 0.41
▸ ALDH1A1 P00352 3/20 0.41
▸ GLA P06280 1/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.39
▸ KCNH2 Q12809 1/20 0.38
▸ MRGPRX2 Q96LB1 1/20 0.38

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
SCHEMBL11826491 0.86 SCN1A (0.44) SCN1ASCN2ASCN3ACNR2HSD11B1
SCHEMBL11830979 0.75 NPSR1 (0.42) SCN1ASCN2ASCN3ACNR2TSHR
SCHEMBL11675026 0.74 TSHR (0.46) CNR2MEN1KMT2ANPC1RAB9A
SCHEMBL4965733 0.74 TSHR (0.53) NPC1RAB9ATSHR
SCHEMBL14000141 0.73 TSHR (0.52) CNR2MEN1KMT2ANPC1RAB9A
SCHEMBL9857416 0.73 TSHR (0.52) CNR2MEN1KMT2ANPC1RAB9A
SCHEMBL11379075 0.73 SLC18A3 (0.44) CNR2MEN1KMT2ANPC1RAB9A
SCHEMBL8959927 0.73 TSHR (0.55) CNR2MEN1KMT2ANPC1RAB9A
SCHEMBL11825775 0.72 TP53 (0.41) CNR2HSD11B1MEN1KMT2ANPC1
SCHEMBL11828894 0.72 CNR2 (0.43) SCN1ASCN2ASCN3ACNR2MEN1

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
US-3974178-A POLYESTER, POLYAMIDE, POLYACRYLONITRILE SUMITOMO CHEMICAL COMPANY, LIMITED (JA) 1976-08-10 — — US disclosed
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