SCHEMBL9717907

SCHEMBL9717907

CCCCCCSC(=S)N(CC)CC

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 4/20 0.56
PHGDH O43175 3/20 0.56
ALDH1A1 P00352 8/20 0.48
ALDH2 P05091 3/20 0.48
CYP2C9 P11712 3/20 0.48
LMNA P02545 3/20 0.48
NFKB1 P19838 3/20 0.48
MAPT P10636 3/20 0.48
CYP3A4 P08684 2/20 0.48
CYP1A2 P05177 2/20 0.48
CYP2C19 P33261 2/20 0.48
HPGD P15428 2/20 0.48
PKM P14618 2/20 0.48
GMNN O75496 2/20 0.48
TP53 P04637 2/20 0.48
HSD17B10 Q99714 2/20 0.48
PLIN1 O60240 1/20 0.48
TRPA1 O75762 1/20 0.48
ABCB11 O95342 1/20 0.48
HSP90AA1 P07900 1/20 0.48

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
SCHEMBL38663739 1.00 MGLL (0.56) MGLLPHGDHALDH1A1ALDH2CYP2C9
SCHEMBL9115859 0.91 MGLL (0.60) MGLLPHGDHALDH1A1ALDH2CYP2C9
SCHEMBL11850426 0.91 MGLL (0.65) MGLLPHGDHALDH1A1ALDH2CYP2C9
Ammonia Solution, Strong SCHEMBL28326734 0.89 MGLL (0.58) MGLLPHGDHALDH1A1ALDH2CYP2C9
SCHEMBL3170327 0.86 MGLL (0.58) MGLLPHGDHALDH1A1ALDH2CYP2C9
SCHEMBL27323584 0.86 ALDH1A1 (0.50) MGLLPHGDHALDH1A1ALDH2CYP2C9
SCHEMBL3166492 0.86 ALDH1A1 (0.61) MGLLPHGDHALDH1A1ALDH2CYP2C9
SCHEMBL10802513 0.83 ALDH1A1 (0.63) MGLLPHGDHALDH1A1ALDH2CYP2C9
SCHEMBL13652904 0.82 MGLL (0.65) MGLLPHGDHALDH1A1ALDH2CYP2C9
SCHEMBL21221395 0.82 MGLL (0.71) MGLLPHGDHALDH1A1ALDH2CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5030368-A Reacting amine or metal dithiocarbamate salt with organophosphorodichloridite MOBIL OIL CORPORATION (US) 1991-07-09 US claimed
US-4867893-A OIL ADDITIVES MOBIL OIL CORPORATION (US) 1989-09-19 US claimed
US-4859356-A OXIDATION, WEAR RESISTANCE MOBIL OIL CORPORATION (US) 1989-08-22 US claimed
US-5126063-A Extreme temperature lubricants MOBIL OIL CORPORATION (US) 1992-06-30 US disclosed
US-5030368-A Reacting amine or metal dithiocarbamate salt with organophosphorodichloridite MOBIL OIL CORPORATION (US) 1991-07-09 US disclosed
US-4859356-A OXIDATION, WEAR RESISTANCE MOBIL OIL CORPORATION (US) 1989-08-22 US disclosed