SCHEMBL24327249

SCHEMBL24327249

Cc1ncsc1-c1ccc(CCC=O)cc1

nearest known ligand 0.55

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
VHL P40337 18/20 0.55
ELOC Q15369 7/20 0.38
ELOB Q15370 7/20 0.38
KDM4E B2RXH2 1/20 0.33
MEN1 O00255 1/20 0.33
ALDH1A1 P00352 1/20 0.33
LMNA P02545 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP2D6 P10635 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33
KMT2A Q03164 1/20 0.33

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
SCHEMBL25592805 0.85 VHL (0.51) VHLELOCELOBKDM4EMEN1
SCHEMBL24269055 0.84 VHL (0.54) VHLELOCELOB
SCHEMBL25006603 0.81 VHL (0.56) VHLELOCELOBKDM4EMEN1
SCHEMBL20111720 0.81 VHL (0.64) VHLELOCELOB
SCHEMBL19598702 0.80 VHL (0.58) VHLELOCELOBKDM4EMEN1
SCHEMBL22487487 0.80 VHL (0.55) VHLKDM4EALDH1A1CYP1A2CYP2C19
Hydrochloric Acid SCHEMBL20213945 0.78 VHL (0.54) VHLCYP1A2KMT2A
SCHEMBL30046450 0.78 VHL (0.60) VHLLMNA
SCHEMBL24440447 0.78 VHL (0.53) VHLELOCELOB
SCHEMBL16276343 0.77 VHL (0.59) VHLELOCELOBKDM4EMEN1

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
WO-2022068933-A1 COMPOUNDS AND METHODS OF TREATING DISEASES CULLGEN (SHANGHAI) , INC. (CN) 2022-04-07 WO disclosed