SCHEMBL7080159

SCHEMBL7080159

O=C(O)OC(=O)NSc1ccccc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.38
FFAR1 O14842 1/20 0.36
LMNA P02545 3/20 0.35
F2 P00734 1/20 0.35
RAB9A P51151 3/20 0.34
NPC1 O15118 3/20 0.34
ALDH1A1 P00352 3/20 0.33
MAPT P10636 2/20 0.33
HPGD P15428 2/20 0.33
POLB P06746 1/20 0.33
KMT2A Q03164 1/20 0.33
MTNR1A P48039 1/20 0.33
MTNR1B P49286 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2D6 P10635 1/20 0.33
CYP2C19 P33261 1/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
RECQL P46063 1/20 0.33
GAA P10253 1/20 0.33

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
SCHEMBL6686836 0.81 HPGD (0.39) TSHRFFAR1RAB9ANPC1ALDH1A1
SCHEMBL5178134 0.76 FFAR1 (0.43) TSHRFFAR1LMNARAB9ANPC1
SCHEMBL132621 0.76 SMN1; SMN2 (0.46) TSHRFFAR1LMNARAB9ANPC1
SCHEMBL3070802 0.76 FFAR1 (0.43) TSHRFFAR1LMNARAB9ANPC1
SCHEMBL19730801 0.76 MEN1 (0.44) TSHRLMNARAB9ANPC1ALDH1A1
SCHEMBL10909193 0.76 GAA (0.53) TSHRLMNARAB9ANPC1ALDH1A1
SCHEMBL133966 0.72 FFAR1 (0.40) TSHRFFAR1LMNARAB9ANPC1
SCHEMBL158241 0.72 SIRT1 (0.42) TSHRFFAR1LMNARAB9ANPC1
SCHEMBL6832557 0.72 HPGD (0.42) TSHRFFAR1LMNAF2RAB9A
SCHEMBL3071125 0.72 FFAR1 (0.45) FFAR1LMNARAB9ANPC1ALDH1A1

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-2003060191-A2 NON-TOXIC CORROSION-PROTECTION CONVERSION COATINGES ABSED ON COBALT UNIVERSITY OF DAYTON (US) 2003-07-24 WO disclosed