SCHEMBL30314531

SCHEMBL30314531

Oc1ccc(O)c2c1SCS2

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIM1 P11309 1/20 0.33
IDO1 P14902 1/20 0.32
APP P05067 1/20 0.30
KDM4E B2RXH2 1/20 0.30
NPC1 O15118 1/20 0.30
CA12 O43570 1/20 0.30
GMNN O75496 1/20 0.30
ALDH1A1 P00352 1/20 0.30
EGFR P00533 1/20 0.30
CA2 P00918 1/20 0.30
LMNA P02545 1/20 0.30
FYN P06241 1/20 0.30
POLB P06746 1/20 0.30
CA3 P07451 1/20 0.30
CYP3A4 P08684 1/20 0.30
MAPT P10636 1/20 0.30
MMP9 P14780 1/20 0.30
HPGD P15428 1/20 0.30
ALOX15 P16050 1/20 0.30
NFKB1 P19838 1/20 0.30

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
SCHEMBL21324025 1.00 PIM1 (0.33) PIM1IDO1APPKDM4ENPC1
SCHEMBL29384591 0.69
SCHEMBL5084742 0.65
SCHEMBL5081702 0.65
SCHEMBL5081705 0.65
SCHEMBL21025833 0.62 CYP1A2 (0.32) CA2
SCHEMBL21323952 0.61 PIM1 (0.32) PIM1IDO1
SCHEMBL6711459 0.56 BCL2L1 (0.42) PIM1IDO1APPKDM4ENPC1
SCHEMBL18068472 0.55 TXNRD1 (0.53) PIM1IDO1APPKDM4ENPC1
SCHEMBL338244 0.55 PIM1 (0.69) PIM1IDO1APPKDM4ENPC1

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
CN-113260598-B Ultraviolet shielding glass AGC株式会社 2023-03-28 CN disclosed