SCHEMBL28643146

SCHEMBL28643146

CC(C)CCNC(C)(N)C(=O)O

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ANPEP P15144 5/20 0.37
RNPEP Q9H4A4 4/20 0.37
DNPEP Q9ULA0 4/20 0.37
RAB9A P51151 3/20 0.34
SMN1; SMN2 Q16637 3/20 0.34
NPC1 O15118 2/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
LAP3 P28838 3/20 0.33
SLC1A3 P43003 1/20 0.32
SLC1A2 P43004 1/20 0.32
SLC1A1 P43005 1/20 0.32
CPA1 P15085 1/20 0.32
LMNA P02545 1/20 0.32
PKM P14618 1/20 0.32
GAA P10253 1/20 0.32
GRM2 Q14416 1/20 0.32
GRM3 Q14832 1/20 0.32
CYP2D6 P10635 1/20 0.31
CYP2C19 P33261 1/20 0.31
CA1 P00915 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
SCHEMBL27797074 0.76 RAB9A (0.34) ANPEPRNPEPDNPEPRAB9ASMN1; SMN2
SCHEMBL5085065 0.75 MEN1 (0.41) LMNACYP2D6CYP2C19
SCHEMBL20115257 0.73 ANPEP (0.31) ANPEPRNPEPDNPEP
SCHEMBL3236355 0.72 GABRR1 (0.39) CPA1CYP2D6CYP2C19
SCHEMBL8591956 0.72 LMNA (0.39) LMNACYP2D6
SCHEMBL27546706 0.72
SCHEMBL8657423 0.70 ANPEP (0.30) ANPEPRNPEPDNPEP
SCHEMBL1310832 0.69 ANPEP (0.46) ANPEPRNPEPDNPEPRAB9ASMN1; SMN2
SCHEMBL4332705 0.68 GGT1 (0.52) SLC1A3SLC1A2SLC1A1GAAGRM2
SCHEMBL27598551 0.68 GGT1 (0.52) SLC1A3SLC1A2SLC1A1GAAGRM2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113429579-A Strong-adsorption branched tertiary amine silanol serving as shale surface hydration inhibitor 西南石油大学 2021-09-24 CN claimed
CN-113429579-B Strong-adsorption branched tertiary amine silanol serving as shale surface hydration inhibitor 西南石油大学 2022-09-30 CN disclosed
CN-113429579-A Strong-adsorption branched tertiary amine silanol serving as shale surface hydration inhibitor 西南石油大学 2021-09-24 CN disclosed