SCHEMBL20529581

SCHEMBL20529581

Cc1ccc(Nc2nccs2)cc1C

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLA2G7 Q13093 1/20 0.70
MAPT P10636 4/20 0.53
ALDH1A1 P00352 4/20 0.53
HPGD P15428 1/20 0.53
ALOX15 P16050 1/20 0.53
HSD17B10 Q99714 1/20 0.53
MEN1 O00255 6/20 0.47
KMT2A Q03164 6/20 0.47
NPC1 O15118 4/20 0.47
RAB9A P51151 4/20 0.47
CASP3 P42574 1/20 0.47
SENP8 Q96LD8 1/20 0.47
SENP7 Q9BQF6 1/20 0.47
SENP6 Q9GZR1 1/20 0.47
DHODH Q02127 2/20 0.46
LMNA P02545 3/20 0.43
PPARG P37231 1/20 0.43
NCOR2 Q9Y618 1/20 0.43
KDM4E B2RXH2 1/20 0.43
GAA P10253 1/20 0.43

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
SCHEMBL14669893 0.85 PLA2G7 (0.65) PLA2G7MAPTALDH1A1HPGDALOX15
SCHEMBL3529772 0.85 PLA2G7 (0.61) PLA2G7MAPTALDH1A1HPGDALOX15
SCHEMBL3038079 0.85 PLA2G7 (0.65) PLA2G7MEN1KMT2ANPC1RAB9A
SCHEMBL3529574 0.85 PLA2G7 (0.65) PLA2G7MAPTALDH1A1ALOX15MEN1
SCHEMBL5762561 0.80 PLA2G7 (0.58) PLA2G7MAPTALDH1A1HPGDHSD17B10
SCHEMBL14662468 0.79 PLA2G7 (0.58) PLA2G7MAPTALDH1A1HPGDMEN1
SCHEMBL851128 0.79 PLA2G7 (0.54) PLA2G7MAPTALDH1A1HSD17B10MEN1
SCHEMBL8906815 0.78 PLA2G7 (0.59) PLA2G7MAPTALDH1A1HPGDHSD17B10
SCHEMBL4238370 0.78 PLA2G7 (0.60) PLA2G7MAPTALDH1A1MEN1KMT2A
SCHEMBL16119591 0.77 PLA2G7 (0.54) PLA2G7MAPTALDH1A1HSD17B10MEN1

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-2018187414-A1 INHIBITORS OF MTOR-RICTOR INTERACTIONS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2018-10-11 WO disclosed