SCHEMBL28217320

SCHEMBL28217320

CCCCCCCCCCCCCCCCN(C)C(C)O

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 4/20 0.50
GGPS1 O95749 3/20 0.41
SPHK1 Q9NYA1 2/20 0.40
CA12 O43570 1/20 0.40
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
CA9 Q16790 1/20 0.40
S1PR2 O95136 1/20 0.39
S1PR1 P21453 1/20 0.39
S1PR3 Q99500 1/20 0.39
S1PR5 Q9H228 1/20 0.39
TSHR P16473 1/20 0.38
THRB P10828 1/20 0.38
GBA1 P04062 1/20 0.38

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
SCHEMBL1036020 1.00 DNM1 (0.50) DNM1GGPS1SPHK1CA12CA1
SCHEMBL1403920 1.00 DNM1 (0.50) DNM1GGPS1SPHK1CA12CA1
SCHEMBL8766777 1.00 DNM1 (0.50) DNM1GGPS1SPHK1CA12CA1
Hydrochloric Acid SCHEMBL28919676 0.98 DNM1 (0.52) DNM1GGPS1SPHK1CA12CA1
Hydrochloric Acid SCHEMBL28187535 0.98 DNM1 (0.52) DNM1GGPS1SPHK1CA12CA1
Hydrochloric Acid SCHEMBL28013671 0.98 DNM1 (0.52) DNM1GGPS1SPHK1CA12CA1
Hydrochloric Acid SCHEMBL8057248 0.98 DNM1 (0.52) DNM1GGPS1SPHK1CA12CA1
Hydrochloric Acid SCHEMBL28268950 0.96 DNM1 (0.50) DNM1GGPS1SPHK1CA12CA1
Alcohol SCHEMBL1176972 0.96 DNM1 (0.46) DNM1GGPS1SPHK1CA12CA1
SCHEMBL1040028 0.90

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-107448777-B Glutinous pour point reducer composition and its preparation method and application drops in a kind of crude oil nanometer 中国科学院化学研究所 2019-05-28 CN claimed
CN-108084982-B Nano viscosity-reducing pour-point depressant stable emulsion, preparation method and application thereof 中国科学院化学研究所 2020-08-21 CN disclosed
CN-107448777-B Glutinous pour point reducer composition and its preparation method and application drops in a kind of crude oil nanometer 中国科学院化学研究所 2019-05-28 CN disclosed
CN-108084982-A Nano-viscosity reduction pour-point depressant stable emulsion and its preparation method and application 中国科学院化学研究所 2018-05-29 CN disclosed