SCHEMBL11684304

SCHEMBL11684304

CN1C(=O)C(Cc2ccccc2)CC1=S

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.48
ALDH1A1 P00352 4/20 0.48
NPC1 O15118 1/20 0.48
RAB9A P51151 1/20 0.48
MEN1 O00255 3/20 0.47
TSHR P16473 3/20 0.47
MAPT P10636 2/20 0.47
GAA P10253 2/20 0.47
L3MBTL1 Q9Y468 1/20 0.45
MAPK1 P28482 1/20 0.44
POLB P06746 2/20 0.44
USP2 O75604 1/20 0.44
PKM P14618 1/20 0.44
HSD11B1 P28845 1/20 0.42
HPGD P15428 1/20 0.40
CES2 O00748 1/20 0.40

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
SCHEMBL30489343 0.78 DRD2 (0.46) KMT2AALDH1A1NPC1RAB9AMEN1
SCHEMBL28995160 0.78 DRD2 (0.46) KMT2AALDH1A1NPC1RAB9AMEN1
SCHEMBL717587 0.74 DDB1 (0.50) KMT2AALDH1A1NPC1RAB9AMEN1
SCHEMBL21133080 0.74 MAPT (0.61) KMT2AALDH1A1MEN1MAPTL3MBTL1
SCHEMBL11687430 0.71 KMT2A (0.69) KMT2AALDH1A1MEN1TSHRL3MBTL1
SCHEMBL29013938 0.70 DDB1 (0.52) KMT2AALDH1A1NPC1RAB9AMEN1
SCHEMBL5088875 0.70 HSD11B1 (0.59) KMT2AALDH1A1NPC1RAB9AHSD11B1
SCHEMBL8379405 0.70 ALDH1A1 (0.57) KMT2AALDH1A1NPC1RAB9AMEN1
SCHEMBL30746804 0.69 KMT2A (0.46) KMT2AALDH1A1NPC1RAB9AMEN1
SCHEMBL29173755 0.69 KMT2A (0.46) KMT2AALDH1A1NPC1RAB9AMEN1

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-4001025-A SILVER SULFIDE, DIGESTION MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1977-01-04 US disclosed