SCHEMBL30685751

SCHEMBL30685751

CN(C)C(O)CCCCCO

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.38
ALDH1A1 P00352 1/20 0.38
HSD17B10 Q99714 1/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
TSHR P16473 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.33
TRPV1 Q8NER1 1/20 0.32
TRPA1 O75762 1/20 0.32
CYP2D6 P10635 2/20 0.30
SPHK1 Q9NYA1 1/20 0.30
GMNN O75496 1/20 0.30
POLB P06746 1/20 0.30
THPO P40225 1/20 0.30
MTOR P42345 1/20 0.30
BLM P54132 1/20 0.30
KDM4E B2RXH2 1/20 0.30
TP53 P04637 1/20 0.30
CYP1A2 P05177 1/20 0.30
CYP3A4 P08684 1/20 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
SCHEMBL5175111 0.97 SMN1; SMN2 (0.35) LMNAALDH1A1HSD17B10MEN1KMT2A
SCHEMBL20608336 0.90
SCHEMBL754078 0.80 GPR84 (0.46) LMNACYP2D6SPHK1GMNNPOLB
SCHEMBL3925045 0.80 GPR84 (0.46) LMNACYP2D6SPHK1GMNNPOLB
SCHEMBL28854810 0.80 GPR84 (0.46) LMNACYP2D6SPHK1GMNNPOLB
SCHEMBL756183 0.80 GPR84 (0.46) LMNACYP2D6SPHK1GMNNPOLB
SCHEMBL755333 0.80 GPR84 (0.46) LMNACYP2D6SPHK1GMNNPOLB
SCHEMBL669598 0.78
Bromide SCHEMBL29184042 0.78 GPR84 (0.45) LMNACYP2D6SPHK1GMNNPOLB
Hydrochloric Acid SCHEMBL29111028 0.78 GPR84 (0.45) LMNACYP2D6SPHK1GMNNPOLB

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-117280086-A Polyurethane elastic thread and method for producing the same 东丽奥培隆特士有限公司 2023-12-22 CN disclosed