SCHEMBL29976395

SCHEMBL29976395

C[S+]([O-])c1nc(-c2ccn(Cc3ccc(Cl)cc3)c2)cc(C(F)(F)F)n1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SDHB P21912 6/20 0.46
▸ MAPT P10636 6/20 0.40
▸ TP53 P04637 1/20 0.40
▸ ADORA2A P29274 1/20 0.40
▸ TDP1 Q9NUW8 1/20 0.40
▸ SMN1; SMN2 Q16637 4/20 0.40
▸ KDM4E B2RXH2 4/20 0.40
▸ ALDH1A1 P00352 3/20 0.40
▸ HSD17B10 Q99714 1/20 0.40
▸ LMNA P02545 3/20 0.37
▸ POLB P06746 2/20 0.37
▸ MEN1 O00255 1/20 0.37
▸ HPGD P15428 1/20 0.37
▸ RAB9A P51151 1/20 0.37
▸ KMT2A Q03164 1/20 0.37
▸ ATM Q13315 1/20 0.37
▸ FABP4 P15090 1/20 0.36
▸ HTT P42858 1/20 0.36
▸ NPSR1 Q6W5P4 1/20 0.36
▸ KDM5B Q9UGL1 1/20 0.36

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
SCHEMBL19805797 1.00 SDHB (0.46) SDHBMAPTTP53ADORA2ATDP1
SCHEMBL19805863 0.90 SDHB (0.49) SDHBSMN1; SMN2ALDH1A1LMNAHPGD
SCHEMBL29976766 0.90 SDHB (0.49) SDHBSMN1; SMN2ALDH1A1LMNAHPGD
SCHEMBL19805642 0.89 SDHB (0.48) SDHBMAPTTP53TDP1SMN1; SMN2
SCHEMBL29976174 0.89 SDHB (0.48) SDHBMAPTTP53TDP1SMN1; SMN2
SCHEMBL29976692 0.82 SDHB (0.50) SDHBMAPTTP53ADORA2ATDP1
SCHEMBL19805660 0.82 SDHB (0.50) SDHBMAPTTP53ADORA2ATDP1
SCHEMBL19805896 0.81 SDHB (0.51) SDHBADORA2AALDH1A1
SCHEMBL19805806 0.81 SDHB (0.47) SDHBMAPTTP53ADORA2ATDP1
SCHEMBL19805811 0.79 SDHB (0.71) SDHBTP53SMN1; SMN2KDM4EALDH1A1

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-110023292-B Apoptosis inhibitors 北京生命科学研究所 2022-10-04 — — CN disclosed
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