SCHEMBL19805923

SCHEMBL19805923

COc1ccc(Cn2cc(-c3cc(C(F)F)nc(SCCCC(=O)NCC4CC5CCCC(C5)C4)n3)ccc2=O)cc1OC

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SDHB P21912 9/20 0.47
▸ MEN1 O00255 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ HPGD P15428 1/20 0.35
▸ MAPT P10636 2/20 0.35
▸ ALDH1A1 P00352 1/20 0.34
▸ POLB P06746 1/20 0.34
▸ GAA P10253 1/20 0.34
▸ PDE2A O00408 1/20 0.34
▸ PDE3A Q14432 1/20 0.34
▸ TP53 P04637 2/20 0.34
▸ KDM4E B2RXH2 1/20 0.34
▸ USP2 O75604 1/20 0.34
▸ LMNA P02545 1/20 0.34
▸ PKM P14618 1/20 0.34
▸ ALOX15 P16050 1/20 0.34
▸ TSHR P16473 1/20 0.34
▸ MAPK1 P28482 1/20 0.34
▸ HTT P42858 1/20 0.34
▸ HSD17B10 Q99714 1/20 0.34

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
SCHEMBL22912209 0.84 SDHB (0.48) SDHBHPGDTP53KDM4EUSP2
SCHEMBL19805988 0.82 SDHB (0.53) SDHBHPGDMAPTALDH1A1PDE2A
SCHEMBL19806088 0.80 SDHB (0.54) SDHBMAPTPDE2APDE3ATP53
SCHEMBL22912277 0.79 SDHB (0.48) SDHBMAPTPDE2APDE3ATP53
SCHEMBL19805996 0.77 SDHB (0.46) SDHBMEN1KMT2AMAPTPOLB
SCHEMBL19805843 0.75 SDHB (0.55) SDHBMAPTPDE2APDE3ATP53
SCHEMBL21019832 0.74 SDHB (0.66) SDHBKMT2AHPGDALDH1A1POLB
SCHEMBL20985729 0.73 SDHB (0.81) SDHBKMT2AALDH1A1POLBGAA
SCHEMBL22912195 0.72 SDHB (0.63) SDHBMEN1KMT2AHPGDMAPT
SCHEMBL26313170 0.72 MKNK1 (0.46) SDHBMEN1KMT2AMAPTALDH1A1

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
WO-2018014802-A1 APOPTOSIS INHIBITORS NATIONAL INSTITUTE OF BIOLOGICAL SCIENCES, BEIJING (CN) 2018-01-25 — — WO disclosed
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