SCHEMBL30697668

SCHEMBL30697668

CCOC(=O)c1sc2ccc(F)c(Cl)c2c1COc1ccc(C(N)=O)cc1

nearest known ligand 0.48

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
STING1 Q86WV6 8/20 0.48
ALDH1A1 P00352 4/20 0.45
KDM4E B2RXH2 3/20 0.45
HPGD P15428 2/20 0.45
GLA P06280 1/20 0.45
GAA P10253 1/20 0.45
TSHR P16473 1/20 0.45
HSD17B10 Q99714 1/20 0.45
PTPN11 Q06124 2/20 0.43
MAPK1 P28482 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
PARP10 Q53GL7 5/20 0.42
MAOB P27338 2/20 0.41
PARP15 Q460N3 1/20 0.41
PARP14 Q460N5 1/20 0.41
LMNA P02545 1/20 0.41
IKBKB O14920 1/20 0.39

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
SCHEMBL23635884 1.00 STING1 (0.48) STING1ALDH1A1KDM4EHPGDGLA
SCHEMBL23635815 0.91 ALDH1A1 (0.46) STING1ALDH1A1KDM4EHPGDGLA
SCHEMBL23635918 0.90 ALDH1A1 (0.44) STING1ALDH1A1KDM4EHPGDGLA
SCHEMBL23635886 0.88 STING1 (0.47) STING1ALDH1A1KDM4EHPGDGLA
SCHEMBL23635858 0.87 STING1 (0.63) STING1ALDH1A1KDM4EHPGDGLA
SCHEMBL30313238 0.87 ALDH1A1 (0.59) STING1ALDH1A1KDM4EHPGDGLA
SCHEMBL23635796 0.87 ALDH1A1 (0.59) STING1ALDH1A1KDM4EHPGDGLA
SCHEMBL23635870 0.86 STING1 (0.53) STING1PARP10MAOBPARP15PARP14
SCHEMBL23635875 0.85 ALDH1A1 (0.59) STING1ALDH1A1KDM4EHPGDGLA
SCHEMBL30697675 0.85 ALDH1A1 (0.59) STING1ALDH1A1KDM4EHPGDGLA

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-3793988-B1 SUBSTITUTED CONDENSED THIOPHENES AS MODULATORS OF STING CTXT PTY LTD (AU) 2023-11-15 EP disclosed