SCHEMBL28952691

SCHEMBL28952691

CCOC(=O)c1sc2cc(C(F)(F)F)ccc2c1S(=O)(=O)CC

nearest known ligand 0.58

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LMNA P02545 5/20 0.58
TP53 P04637 2/20 0.58
MAPT P10636 9/20 0.46
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
KDM4E B2RXH2 1/20 0.46
HSP90AA1 P07900 1/20 0.46
CRHBP P24387 1/20 0.46
CRHR2 Q13324 1/20 0.46
THRB P10828 1/20 0.43
ALDH1A1 P00352 1/20 0.42
HPGD P15428 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
CYP1A2 P05177 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
DHODH Q02127 1/20 0.40

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
SCHEMBL29938032 0.85 LMNA (0.42) LMNATP53KDM4EALDH1A1CYP2C9
SCHEMBL28836383 0.85 LMNA (0.42) LMNATP53KDM4EALDH1A1CYP2C9
SCHEMBL30099150 0.82 LMNA (0.48) LMNATP53MAPTMEN1KMT2A
SCHEMBL8136940 0.82 KDM4E (0.51) LMNATP53MAPTMEN1KMT2A
SCHEMBL28836579 0.82 LMNA (0.48) LMNATP53MAPTMEN1KMT2A
SCHEMBL28836319 0.79 MAPT (0.47) LMNATP53MAPTMEN1KMT2A
SCHEMBL3683576 0.77 LMNA (0.53) LMNATP53MAPTMEN1KMT2A
SCHEMBL28836407 0.76 EPHX2 (0.39) LMNATP53MEN1KMT2A
SCHEMBL29937736 0.76 EPHX2 (0.39) LMNATP53MEN1KMT2A
SCHEMBL4337592 0.75 DHODH (0.50) LMNATP53MAPTMEN1KMT2A

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-115023426-A Pesticidally active heterocyclic derivatives with sulfur-containing substituents 先正达农作物保护股份公司 2022-09-06 CN disclosed