SCHEMBL28611101

SCHEMBL28611101

CCCOP(=O)(O)ON.[NaH].[NaH].[NaH].[NaH]

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
LPAR3 Q9UBY5 5/20 0.39
LPAR1 Q92633 3/20 0.39
LPAR2 Q9HBW0 3/20 0.39
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
CYP3A4 P08684 1/20 0.34
BTN3A1 O00481 1/20 0.34
LPAR5 Q9H1C0 1/20 0.33
FDPS P14324 1/20 0.32
P2RY10 O00398 1/20 0.31

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
SCHEMBL28388064 1.00 LPAR3 (0.39) LPAR3LPAR1LPAR2MEN1KMT2A
SCHEMBL302912 0.98
SCHEMBL9499739 0.84 CYP3A4 (0.54) LPAR3LPAR1LPAR2CYP3A4P2RY10
SCHEMBL497177 0.83 LPAR3 (0.46) LPAR3LPAR1LPAR2MEN1KMT2A
SCHEMBL1537958 0.83 LPAR3 (0.61) LPAR3LPAR1LPAR2CYP3A4LPAR5
SCHEMBL10726660 0.81
SCHEMBL2563554 0.81 LPAR3 (0.64) LPAR3LPAR1LPAR2CYP3A4LPAR5
SCHEMBL4072457 0.81 LPAR3 (0.64) LPAR3LPAR1LPAR2CYP3A4LPAR5
SCHEMBL9495760 0.81 LPAR3 (0.64) LPAR3LPAR1LPAR2CYP3A4LPAR5
SCHEMBL9497660 0.81 LPAR3 (0.64) LPAR3LPAR1LPAR2CYP3A4LPAR5

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
CN-112553011-A Cleaning agent for non-stop cleaning of blast furnace circulating cooling water system in steel plant 广西蒲公英环保科技有限公司 2021-03-26 CN claimed
CN-113136187-A Neutral gradient water injection particle migration anti-blocking system and preparation method thereof 中国地质大学(武汉) 2021-07-20 CN disclosed
CN-112553011-A Cleaning agent for non-stop cleaning of blast furnace circulating cooling water system in steel plant 广西蒲公英环保科技有限公司 2021-03-26 CN disclosed
CN-112553011-A Cleaning agent for non-stop cleaning of blast furnace circulating cooling water system in steel plant 广西蒲公英环保科技有限公司 2021-03-26 CN disclosed