SCHEMBL9649339

SCHEMBL9649339

CCCCC(CC)COP(=S)([S-])OCC(CC)CCCC.CCCCC(CC)COP(=S)([S-])OCC(CC)CCCC.CCCCC(CC)COP(=S)([S-])OCC(CC)CCCC.O=[Mo+3]

nearest known ligand 0.61

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 6/20 0.61
L3MBTL1 Q9Y468 1/20 0.61
TSHR P16473 4/20 0.44
TDP1 Q9NUW8 3/20 0.44
ATM Q13315 1/20 0.44
ALDH1A1 P00352 8/20 0.39
CA2 P00918 3/20 0.39
RECQL P46063 1/20 0.37
LMNA P02545 3/20 0.35
MMP9 P14780 1/20 0.35
MMP8 P22894 1/20 0.35
MMP14 P50281 1/20 0.35
MAPK1 P28482 2/20 0.35
HSD17B10 Q99714 1/20 0.35
PRSS1 P07477 1/20 0.34
PRSS2 P07478 1/20 0.34
PRSS3 P35030 1/20 0.34

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
SCHEMBL8081922 0.93 CYP3A4 (0.61) CYP3A4L3MBTL1TSHRTDP1ATM
SCHEMBL8081920 0.93 CYP3A4 (0.61) CYP3A4L3MBTL1TSHRTDP1ATM
SCHEMBL7516775 0.93 CYP3A4 (0.61) CYP3A4L3MBTL1TSHRTDP1ATM
SCHEMBL4463574 0.93 CYP3A4 (0.59) CYP3A4L3MBTL1TSHRTDP1ATM
Zinc Ion SCHEMBL166463 0.93 CYP3A4 (0.59) CYP3A4L3MBTL1TSHRTDP1ATM
SCHEMBL8365435 0.93 CYP3A4 (0.59) CYP3A4L3MBTL1TSHRTDP1ATM
SCHEMBL8610580 0.93 CYP3A4 (0.59) CYP3A4L3MBTL1TSHRTDP1ATM
SCHEMBL6693742 0.93 CYP3A4 (0.59) CYP3A4L3MBTL1TSHRTDP1ATM
SCHEMBL9076587 0.93 CYP3A4 (0.59) CYP3A4L3MBTL1TSHRTDP1ATM
SCHEMBL7557219 0.93 CYP3A4 (0.59) CYP3A4L3MBTL1TSHRTDP1ATM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5055174-A Mixing molybdenum dithiophosphates; contacting with hydrogen; minimizing cokeable components PHILLIPS PETROLEUM COMPANY (US) 1991-10-08 US claimed
US-4728417-A DEMETALLIZATION, CATALYST REJUVENATION PHILLIPS PETROLEUM COMPANY (US) 1988-03-01 US claimed
US-4608152-A USING MIXTURE OF MOLYBDENUM DITHIOPHOSPATE AND MOLYBDENUM CARBOXYLATE PHILLIPS PETROLEUM COMPANY (US) 1986-08-26 US claimed
US-4560468-A USING DECOMPOSABLE MOLYBDENUM DITHIOPHOSPHATE COMPOUND PHILLIPS PETROLEUM COMPANY (US) 1985-12-24 US claimed
EP-0255888-B1 HYDROFINING PROCESS FOR HYDROCARBON CONTAINING FEED STREAMS PHILLIPS PETROLEUM COMPANY (US) 1992-11-11 EP disclosed
US-5055174-A Mixing molybdenum dithiophosphates; contacting with hydrogen; minimizing cokeable components PHILLIPS PETROLEUM COMPANY (US) 1991-10-08 US disclosed
US-4728417-A DEMETALLIZATION, CATALYST REJUVENATION PHILLIPS PETROLEUM COMPANY (US) 1988-03-01 US disclosed
US-4705766-A Mixture of a molybdenum carboxylate and a molybdenum dithiophosphate or a molybdenum dithiocarbamate for use in a hydrovisbreaking process PHILLIPS PETROLEUM COMPANY (US) 1987-11-10 US disclosed
US-4659452-A HYDROGENATION IN PRESENCE OF INORGANIC REFRACTORY, HYDROVISBREAKING PHILLIPS PETROLEUM (US) 1987-04-21 US disclosed
US-4608152-A USING MIXTURE OF MOLYBDENUM DITHIOPHOSPATE AND MOLYBDENUM CARBOXYLATE PHILLIPS PETROLEUM COMPANY (US) 1986-08-26 US disclosed
US-4592830-A Producing crude oil PHILLIPS PETROLEUM COMPANY (US) 1986-06-03 US disclosed
US-4560468-A USING DECOMPOSABLE MOLYBDENUM DITHIOPHOSPHATE COMPOUND PHILLIPS PETROLEUM COMPANY (US) 1985-12-24 US disclosed