SCHEMBL23628847

SCHEMBL23628847

N#CS[C@H](C=O)c1ccc(-c2ccc(F)cc2)cc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 5/20 0.36
SMN1; SMN2 Q16637 4/20 0.36
ALDH1A1 P00352 4/20 0.36
ALPG P10696 2/20 0.36
FFAR1 O14842 1/20 0.34
HPGD P15428 2/20 0.33
USP2 O75604 1/20 0.33
HTT P42858 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
ERBB2 P04626 1/20 0.33
TDP1 Q9NUW8 1/20 0.32
BCL2L1 Q07817 1/20 0.32
BAD Q92934 1/20 0.32
CTSL P07711 1/20 0.32
CTSB P07858 1/20 0.32
CTSS P25774 1/20 0.32
CTSK P43235 1/20 0.32
MYC P01106 1/20 0.31
WDR5 P61964 1/20 0.31
KDM4E B2RXH2 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
SCHEMBL4073531 0.95 LMNA (0.39) LMNASMN1; SMN2ALDH1A1ALPGHPGD
SCHEMBL3633293 0.77 HSD17B10 (0.34) LMNAALDH1A1HPGDTDP1
SCHEMBL23628841 0.77 TSHR (0.38) LMNASMN1; SMN2ALDH1A1HPGDUSP2
SCHEMBL2494300 0.77 KIF11 (0.37) FFAR1MYCWDR5
SCHEMBL23628844 0.73 DPP4 (0.37) CTSLCTSSCTSK
SCHEMBL3974300 0.73 S1PR3 (0.35)
SCHEMBL8053155 0.67 LMNA (0.38) LMNASMN1; SMN2ALDH1A1ALPGHPGD
SCHEMBL2550741 0.67 LMNA (0.46) LMNASMN1; SMN2ALDH1A1ALPGHPGD
SCHEMBL27032802 0.65 BCL2L1 (0.44) LMNASMN1; SMN2ALDH1A1ALPGFFAR1
SCHEMBL8487888 0.63 ATM (0.43) LMNASMN1; SMN2ALDH1A1NPSR1TDP1

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
EP-3846793-A1 EIF4E INHIBITORS AND USES THEREOF PIC Therapeutics, Inc. (US) 2021-07-14 EP disclosed