SCHEMBL7416478

SCHEMBL7416478

NC(=O)c1ccccc1CS

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.50
ALDH1A1 P00352 2/20 0.50
MAPT P10636 2/20 0.50
TSHR P16473 2/20 0.50
HSD17B10 Q99714 2/20 0.50
HPGD P15428 1/20 0.50
FOLH1 Q04609 1/20 0.47
METAP2 P50579 1/20 0.47
BCAT2 O15382 1/20 0.45
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
DCLRE1A Q6PJP8 1/20 0.42
DCLRE1B Q9H816 1/20 0.42
IDO1 P14902 1/20 0.41
GAA P10253 1/20 0.41
CTNNB1 P35222 1/20 0.41
SIRT1 Q96EB6 1/20 0.41
NPC1 O15118 2/20 0.40
IRAK4 Q9NWZ3 1/20 0.40
RAB9A P51151 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
SCHEMBL17395959 0.83 FOLH1 (0.69) KDM4EALDH1A1MAPTTSHRHSD17B10
SCHEMBL4735612 0.82 ALDH1A1 (0.54) KDM4EALDH1A1MAPTTSHRHSD17B10
SCHEMBL7134588 0.82 TSHR (0.54) KDM4EALDH1A1MAPTTSHRHSD17B10
SCHEMBL14899751 0.82 KDM4E (0.41) KDM4EALDH1A1MAPTTSHRHSD17B10
SCHEMBL6555382 0.80 MAPT (0.52) KDM4EALDH1A1MAPTTSHRHSD17B10
SCHEMBL2356669 0.80 FOLH1 (0.70) KDM4EALDH1A1MAPTTSHRHPGD
SCHEMBL405123 0.80 KDM4E (0.52) KDM4EALDH1A1MAPTTSHRHSD17B10
SCHEMBL619877 0.80 ALDH1A1 (0.52) KDM4EALDH1A1MAPTTSHRHSD17B10
SCHEMBL162322 0.80 MAPT (0.52) KDM4EALDH1A1MAPTTSHRHSD17B10
Benzene SCHEMBL1931924 0.80 FOLH1 (0.70) KDM4EALDH1A1MAPTTSHRHPGD

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105165823-A Enhanced Retention Capabilities Through Methods Comprising Surface Treatment Of Functional Particulate Carrier Materials, And Functional Particulate Carrier Materials Made Therefrom WORLD MINERALS INC 2015-12-23 CN disclosed
US-5733905-A CONGESTIVE HEART FAILURE; KIDNEY DISORDERS AMERICAN CYANAMID COMPANY (US) 1998-03-31 US disclosed