SCHEMBL29928482

SCHEMBL29928482

CCCCCCCCCCCCCCCCCCCCCCCN(C)CCC

nearest known ligand 0.60

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 3/20 0.60
S1PR2 O95136 1/20 0.56
S1PR1 P21453 1/20 0.56
S1PR3 Q99500 1/20 0.56
S1PR5 Q9H228 1/20 0.56
SIGMAR1 Q99720 1/20 0.52
CHRM2 P08172 1/20 0.50
TSHR P16473 1/20 0.47
THRB P10828 1/20 0.47
GGPS1 O95749 4/20 0.47
KDM5A P29375 4/20 0.46
KDM4C Q9H3R0 3/20 0.46
PHF8 Q9UPP1 1/20 0.46
FDPS P14324 1/20 0.45
AGTR1 P30556 1/20 0.45
OPRM1 P35372 1/20 0.45
PDE3A Q14432 1/20 0.45
KDM5C P41229 1/20 0.42
KDM5B Q9UGL1 1/20 0.42

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
SCHEMBL31168306 1.00 DNM1 (0.60) DNM1S1PR2S1PR1S1PR3S1PR5
SCHEMBL8625464 1.00 DNM1 (0.60) DNM1S1PR2S1PR1S1PR3S1PR5
SCHEMBL117987 1.00 DNM1 (0.60) DNM1S1PR2S1PR1S1PR3S1PR5
SCHEMBL15535338 1.00 DNM1 (0.60) DNM1S1PR2S1PR1S1PR3S1PR5
SCHEMBL516694 1.00 DNM1 (0.60) DNM1S1PR2S1PR1S1PR3S1PR5
SCHEMBL15407868 1.00 DNM1 (0.60) DNM1S1PR2S1PR1S1PR3S1PR5
SCHEMBL4869710 1.00 DNM1 (0.60) DNM1S1PR2S1PR1S1PR3S1PR5
SCHEMBL20298464 1.00 DNM1 (0.60) DNM1S1PR2S1PR1S1PR3S1PR5
SCHEMBL11870492 1.00 DNM1 (0.60) DNM1S1PR2S1PR1S1PR3S1PR5
SCHEMBL22654 1.00 DNM1 (0.60) DNM1S1PR2S1PR1S1PR3S1PR5

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-118743646-A Suspension stabilizer composition and preparation method thereof 南京华狮新材料有限公司 2024-10-08 CN disclosed
CN-117957291-A Aqueous surface treatment composition 迈图高新材料公司 2024-04-30 CN disclosed
CN-116785184-A Vesicle with ligands of dermal and epidermal cell receptors, and preparation method and application thereof 华熙生物科技股份有限公司 2023-09-22 CN disclosed
CN-115040426-A Skin cleaning composition based on soap-based system 广东嘉丹婷日用品有限公司 2022-09-13 CN disclosed