SCHEMBL15224191

SCHEMBL15224191

CC(C)(C)NC(=S)NCCC(N)=O

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 2/20 0.45
NPC1 O15118 1/20 0.45
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
EPHX1 P07099 2/20 0.44
QPCT Q16769 1/20 0.42
ALDH1A1 P00352 5/20 0.38
KDM4E B2RXH2 1/20 0.36
MAPT P10636 1/20 0.36
SMN1; SMN2 Q16637 2/20 0.35
ECE1 P42892 1/20 0.34
MAPKAPK2 P49137 1/20 0.34
POLB P06746 1/20 0.33
HPGD P15428 1/20 0.33
GAA P10253 1/20 0.32
RECQL P46063 1/20 0.32
HTT P42858 2/20 0.32

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
SCHEMBL15224154 0.80 NPC1 (0.47) RAB9ANPC1MEN1KMT2AEPHX1
SCHEMBL24860396 0.76 ALDH1A1 (0.54) MEN1KMT2AALDH1A1KDM4EGAA
SCHEMBL21214049 0.75 MEN1 (0.52) RAB9ANPC1MEN1KMT2AEPHX1
SCHEMBL6211416 0.74 ALDH1A1 (0.39) RAB9ANPC1MEN1KMT2AEPHX1
SCHEMBL19420693 0.73 MEN1 (0.55) RAB9ANPC1MEN1KMT2AEPHX1
SCHEMBL10907938 0.73 KMT2A (0.55) RAB9ANPC1MEN1KMT2AEPHX1
SCHEMBL11311904 0.73 KMT2A (0.55) RAB9ANPC1MEN1KMT2AEPHX1
SCHEMBL15224193 0.72 MEN1 (0.48) RAB9ANPC1MEN1KMT2AEPHX1
SCHEMBL5544335 0.71 POLB (0.42) MEN1KMT2AEPHX1ALDH1A1KDM4E
SCHEMBL2734579 0.70 ALDH1A1 (0.32) MEN1KMT2AALDH1A1ECE1POLB

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-8524894-B2 Inhibitor compounds of 11-beta-hydroxysteroid dehydrogenase type 1 LABORATORIOS SALVAT, S.A. (ES) 2013-09-03 US disclosed