SCHEMBL7983683

SCHEMBL7983683

C[C@H](CNC(=O)OC(C)(C)C)c1c[nH]c2cc(O)ccc12

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 4/20 0.51
MTNR1A P48039 2/20 0.47
MTNR1B P49286 2/20 0.47
NQO2 P16083 1/20 0.42
MAP1LC3B Q9GZQ8 1/20 0.39
MAP1LC3A Q9H492 1/20 0.39
SPR P35270 1/20 0.39
TYR P14679 1/20 0.38
SCN9A Q15858 2/20 0.38
SYK P43405 1/20 0.37
SERPINE1 P05121 1/20 0.37
TP53 P04637 1/20 0.37
MAPT P10636 1/20 0.37
TACR1 P25103 1/20 0.37
CTSL P07711 1/20 0.36
CTSS P25774 1/20 0.36
CTSK P43235 1/20 0.36
HTR2A P28223 1/20 0.36
HTR2C P28335 1/20 0.36
HTR2B P41595 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
SCHEMBL17826925 0.88 AAK1 (0.46) TRPV1MTNR1AMTNR1BSCN9AAAK1
SCHEMBL23126845 0.85 MAPT (0.50) TRPV1MTNR1AMTNR1BTP53MAPT
SCHEMBL29378369 0.85 MAPT (0.50) TRPV1MTNR1AMTNR1BTP53MAPT
SCHEMBL28552129 0.85 MAPT (0.50) TRPV1MTNR1AMTNR1BTP53MAPT
SCHEMBL7995640 0.83 ALDH1A1 (0.50) TRPV1MTNR1AMTNR1BSCN9ASYK
Trimethylammonium SCHEMBL9095683 0.82 MAPT (0.47) TRPV1MTNR1AMTNR1BTP53MAPT
SCHEMBL7998062 0.81 TRPV1 (0.46) TRPV1MTNR1AMTNR1BMAPTTACR1
SCHEMBL17826908 0.81 MTNR1A (0.54) TRPV1MTNR1AMTNR1BAAK1
SCHEMBL1249782 0.80 MTNR1A (0.56) TRPV1MTNR1AMTNR1BSCN9ASERPINE1
SCHEMBL2534000 0.77 TYR (0.62) TRPV1MTNR1AMTNR1BNQO2SPR

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-2001040183-A1 1-AMINOALKYL-1H-INDOLES FOR TREATING GLAUCOMA ALCON UNIVERSAL LTD. (CH) 2001-06-07 WO disclosed