SCHEMBL28486540

SCHEMBL28486540

CCCO[PH](=O)O.[NaH].[NaH].[NaH].[NaH]

nearest known ligand 0.31

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.31
LPAR3 Q9UBY5 3/20 0.30
LPAR1 Q92633 2/20 0.30
LPAR2 Q9HBW0 2/20 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
SCHEMBL28990424 1.00
SCHEMBL282710 0.97
Ammonia Solution, Strong SCHEMBL1777240 0.94
SCHEMBL27343444 0.94 TSHR (0.31) TSHRLPAR3LPAR1LPAR2
Butane SCHEMBL4247130 0.94 TSHR (0.31) TSHRLPAR3LPAR1LPAR2
SCHEMBL27808846 0.94
Ethyne SCHEMBL29078664 0.92
Propene SCHEMBL29078665 0.85 HPGD (0.33) TSHR
SCHEMBL7117034 0.84 ALDH1A1 (0.41) TSHRLPAR3LPAR1LPAR2
SCHEMBL2539500 0.82 LPAR3 (0.45) TSHRLPAR3LPAR1LPAR2

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-111892361-A Quick-setting cement-based permeable crystallization type waterproof material and preparation method thereof 安徽朗凯奇建材有限公司 2020-11-06 CN disclosed