SCHEMBL28037285

SCHEMBL28037285

CCN(CC)C(=S)SCCC#N

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PHGDH O43175 3/20 0.54
MGLL Q99685 3/20 0.54
ALDH1A1 P00352 9/20 0.46
LMNA P02545 4/20 0.46
HPGD P15428 4/20 0.46
CYP3A4 P08684 3/20 0.46
NFKB1 P19838 3/20 0.46
PKM P14618 3/20 0.46
HTT P42858 3/20 0.46
ALDH2 P05091 2/20 0.46
CYP1A2 P05177 2/20 0.46
TSHR P16473 2/20 0.46
CYP2C19 P33261 2/20 0.46
ABCB11 O95342 2/20 0.46
ACHE P22303 2/20 0.46
GSDMD P57764 2/20 0.46
EHMT2 Q96KQ7 2/20 0.46
EHMT1 Q9H9B1 2/20 0.46
PLIN1 O60240 1/20 0.46
GMNN O75496 1/20 0.46

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
SCHEMBL21221395 0.80 MGLL (0.71) PHGDHMGLLALDH1A1LMNAHPGD
SCHEMBL3408166 0.79 MGLL (0.58) PHGDHMGLLALDH1A1LMNAHPGD
SCHEMBL11541178 0.77 MGLL (0.45) PHGDHMGLLALDH1A1LMNAHPGD
SCHEMBL11850426 0.76 MGLL (0.65) PHGDHMGLLALDH1A1LMNAHPGD
SCHEMBL13652904 0.76 MGLL (0.65) PHGDHMGLLALDH1A1LMNAHPGD
SCHEMBL2145837 0.74 MGLL (0.62) PHGDHMGLLALDH1A1LMNAHPGD
SCHEMBL27668756 0.72 MGLL (0.60) PHGDHMGLLALDH1A1LMNAHPGD
SCHEMBL29710514 0.72
SCHEMBL9115859 0.72 MGLL (0.60) PHGDHMGLLALDH1A1LMNAHPGD
SCHEMBL30297013 0.72 CYP1A2 (0.33) CYP3A4CYP1A2TSHRCYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023024583-A1 METHOD FOR FLOTATION OF COMPLEX DIFFICULT TO PROCESS COPPER SILVER SULFIDE ORE 中钢集团马鞍山矿山研究总院股份有限公司 2023-03-02 WO claimed
CN-114918035-A Method for recovering chalcopyrite from pyrite and pyrrhotite 铜陵有色金属集团股份有限公司 2022-08-19 CN claimed
CN-114918035-A Method for recovering chalcopyrite from pyrite and pyrrhotite 铜陵有色金属集团股份有限公司 2022-08-19 CN disclosed
CN-105149104-A Beneficiation method for treating copper smelting slag NORTHWEST RES INST OF MINING AND METALLURG INST 2015-12-16 CN disclosed