SCHEMBL30801480

SCHEMBL30801480

CCOC(=O)C1(N)CC2(CC(F)(F)C2)C1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.37
ALDH1A1 P00352 3/20 0.36
TRPA1 O75762 1/20 0.36
ALOX15 P16050 3/20 0.34
MGAM O43451 1/20 0.34
GAA P10253 1/20 0.34
SI P14410 1/20 0.34
MGAM2 Q2M2H8 1/20 0.34
CYP1A2 P05177 1/20 0.32
ATM Q13315 1/20 0.32
LMNA P02545 1/20 0.31
HSD17B10 Q99714 1/20 0.31
KMT2A Q03164 2/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
SOAT1 P35610 1/20 0.30
OPRM1 P35372 1/20 0.30
KDM4E B2RXH2 1/20 0.30
MEN1 O00255 1/20 0.30
MAPT P10636 1/20 0.30
CA12 O43570 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
SCHEMBL1434672 0.83 POLB (0.40) POLBALDH1A1TRPA1ALOX15MGAM
SCHEMBL30801473 0.76 POLB (0.35) POLBALDH1A1TRPA1ATM
SCHEMBL1968188 0.75 POLB (0.46) POLBALDH1A1TRPA1ALOX15MGAM
SCHEMBL372547 0.74
SCHEMBL15085798 0.73 POLB (0.41) POLBALDH1A1TRPA1ALOX15MGAM
SCHEMBL11643308 0.73 POLB (0.45) POLBALDH1A1TRPA1ALOX15MGAM
Hydrochloric Acid SCHEMBL741807 0.72 ALOX15 (0.42) POLBALDH1A1TRPA1ALOX15MGAM
SCHEMBL22441532 0.72
Hydrochloric Acid SCHEMBL20447769 0.72 ALOX15 (0.42) POLBALDH1A1TRPA1ALOX15MGAM
SCHEMBL13640410 0.72 POLB (0.40) POLBALDH1A1TRPA1ALOX15MGAM

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-117551037-A Compounds as succinate dehydrogenase inhibitors and uses thereof 华东理工大学 2024-02-13 CN disclosed