SCHEMBL28307448

SCHEMBL28307448

COCCOCCSc1nc(C2=CN(Cc3ccc(OC)c(OC)c3)CC=C2)cc(C(F)(F)F)n1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 5/20 0.42
▸ HSD17B10 Q99714 4/20 0.42
▸ MAPK1 P28482 3/20 0.42
▸ USP2 O75604 2/20 0.42
▸ TP53 P04637 2/20 0.42
▸ LMNA P02545 1/20 0.42
▸ PKM P14618 1/20 0.42
▸ ALOX15 P16050 1/20 0.42
▸ TSHR P16473 1/20 0.42
▸ HTT P42858 1/20 0.42
▸ ALDH1A1 P00352 4/20 0.41
▸ HPGD P15428 4/20 0.41
▸ SDHB P21912 3/20 0.41
▸ MAPT P10636 6/20 0.39
▸ BRCA1 P38398 1/20 0.39
▸ L3MBTL1 Q9Y468 1/20 0.39
▸ SMN1; SMN2 Q16637 2/20 0.38
▸ GAA P10253 1/20 0.38
▸ THRB P10828 1/20 0.36
▸ RXFP1 Q9HBX9 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
SCHEMBL30526106 0.79 SDHB (0.59) KDM4EHSD17B10MAPK1USP2TP53
SCHEMBL28307462 0.79 SDHB (0.59) KDM4EHSD17B10MAPK1USP2TP53
SCHEMBL28307461 0.77 SDHB (0.39) KDM4EHSD17B10USP2TP53LMNA
SCHEMBL30526113 0.77 SDHB (0.69) KDM4EHSD17B10MAPK1USP2ALDH1A1
SCHEMBL19806068 0.77 SDHB (0.69) KDM4EHSD17B10MAPK1USP2ALDH1A1
SCHEMBL28307452 0.76 SDHB (0.48) KDM4EHSD17B10TP53LMNATSHR
SCHEMBL28307434 0.75 SDHB (0.63) KDM4EHSD17B10TP53LMNAHTT
SCHEMBL28306444 0.74 SDHB (0.54) KDM4EHSD17B10MAPK1TP53LMNA
SCHEMBL28306456 0.74 SDHB (0.64) KDM4EHSD17B10TP53LMNAHTT
SCHEMBL28306298 0.73 SDHB (0.50) HSD17B10MAPK1TP53LMNATSHR

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-A Apoptosis inhibitor 北京生命科学研究所 2019-07-16 — — CN disclosed
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