SCHEMBL8445933

SCHEMBL8445933

CCC(=O)NC(C)(C)c1ccc(C)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.49
NPC1 O15118 4/20 0.47
RAB9A P51151 4/20 0.47
MAPT P10636 1/20 0.47
ALDH1A1 P00352 3/20 0.44
GAA P10253 2/20 0.44
POLB P06746 1/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
ADORA3 P0DMS8 1/20 0.41
TSHR P16473 1/20 0.40
P2RX7 Q99572 1/20 0.40
ACACB O00763 1/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
TDP1 Q9NUW8 1/20 0.39
HCRTR1 O43613 1/20 0.38
HCRTR2 O43614 1/20 0.38
KDM4E B2RXH2 1/20 0.38
HDAC1 Q13547 1/20 0.38
HDAC6 Q9UBN7 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
SCHEMBL8443619 0.84 L3MBTL1 (0.49) NPC1RAB9AMAPTALDH1A1POLB
SCHEMBL23343879 0.83 P2RX7 (0.50) HPGDRAB9AMAPTALDH1A1GAA
SCHEMBL11314901 0.82 NPC1 (0.45) HPGDNPC1RAB9AMAPTALDH1A1
SCHEMBL29657118 0.80 HPGD (0.42) HPGDNPC1RAB9AMAPTALDH1A1
SCHEMBL8446830 0.80 NPC1 (0.48) HPGDNPC1RAB9AMAPTALDH1A1
SCHEMBL16906730 0.80 LMNA (0.49) HPGDNPC1RAB9AMAPTALDH1A1
SCHEMBL8351698 0.79 ACACB (0.49) HPGDNPC1RAB9AMAPTALDH1A1
SCHEMBL9971091 0.77 NPC1 (0.46) HPGDNPC1RAB9AMAPTALDH1A1
SCHEMBL27291104 0.76 TDP1 (0.45) HPGDNPC1RAB9AMAPTALDH1A1
SCHEMBL15308114 0.76 NPC1 (0.44) HPGDNPC1RAB9AMAPTALDH1A1

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
EP-0618907-B1 1-(ARYLALKYL-AMINOALKYL)IMIDAZOLE DERIVATIVES, PROCESSES OF PREPARATION AND USE AS THERAPEUTICAL AGENTS BRITISH TECH GROUP INT (GB) 1999-04-28 EP disclosed