SCHEMBL30697663

SCHEMBL30697663

CCOC(=O)c1sc2c(F)ccc(F)c2c1COc1c(F)cc(C(N)=O)cc1F

nearest known ligand 0.64

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
STING1 Q86WV6 15/20 0.64
ALDH1A1 P00352 4/20 0.42
HPGD P15428 4/20 0.42
KDM4E B2RXH2 3/20 0.42
HSD17B10 Q99714 3/20 0.42
TSHR P16473 2/20 0.42
GLA P06280 1/20 0.42
GAA P10253 1/20 0.42
LMNA P02545 1/20 0.40
ALOX15 P16050 2/20 0.38
NPSR1 Q6W5P4 1/20 0.38
NPC1 O15118 1/20 0.37
MAPT P10636 1/20 0.37
RAB9A P51151 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37

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
SCHEMBL23635868 1.00 STING1 (0.64) STING1ALDH1A1HPGDKDM4EHSD17B10
SCHEMBL23635864 0.92 STING1 (0.77) STING1ALDH1A1HPGDKDM4EHSD17B10
SCHEMBL23635903 0.92 STING1 (0.77) STING1ALDH1A1HPGDKDM4EHSD17B10
SCHEMBL23635865 0.86 STING1 (0.47) STING1ALDH1A1HPGDKDM4EHSD17B10
SCHEMBL30697676 0.86 STING1 (0.47) STING1ALDH1A1HPGDKDM4EHSD17B10
SCHEMBL23630832 0.86 STING1 (0.84) STING1
SCHEMBL23112016 0.86 STING1 (0.68) STING1ALDH1A1HPGDKDM4EHSD17B10
SCHEMBL23112039 0.85 STING1 (0.81) STING1ALDH1A1HPGDKDM4EHSD17B10
SCHEMBL23635858 0.85 STING1 (0.63) STING1ALDH1A1HPGDKDM4EHSD17B10
SCHEMBL23111978 0.84 STING1 (0.78) STING1ALDH1A1HPGDKDM4EHSD17B10

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