SCHEMBL17307308

SCHEMBL17307308

Cc1c(O)cc(CCCCCCCCCCP(c2ccccc2)c2ccccc2)c(O)c1C

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TYR P14679 2/20 0.40
▸ BID P55957 7/20 0.34
▸ MCL1 Q07820 7/20 0.34
▸ BCL2L1 Q07817 6/20 0.34
▸ BAK1 Q16611 6/20 0.34
▸ KAT8 Q9H7Z6 2/20 0.34
▸ SAE1 Q9UBE0 2/20 0.34
▸ PPARG P37231 1/20 0.34
▸ PPARA Q07869 1/20 0.34
▸ EP300 Q09472 1/20 0.34
▸ KAT2A Q92830 1/20 0.34
▸ KAT2B Q92831 1/20 0.34
▸ KAT5 Q92993 1/20 0.34
▸ MMP2 P08253 2/20 0.33
▸ F7 P08709 2/20 0.33
▸ F3 P13726 2/20 0.33
▸ MAPT P10636 2/20 0.33
▸ ALOX15 P16050 2/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ ECE1 P42892 1/20 0.33

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
SCHEMBL17307113 0.80 KDM4E (0.31) TYRMMP2MAPTKDM4EHSD17B10
SCHEMBL12195876 0.75 TYR (0.40) TYRBIDMCL1BCL2L1BAK1
SCHEMBL25608103 0.75 TYR (0.40) TYRBIDMCL1BCL2L1BAK1
SCHEMBL15214282 0.74 TYR (0.64) TYRBIDMCL1BCL2L1BAK1
SCHEMBL17988280 0.74 TYR (0.46) TYRMAPTALOX15MEN1TP53
SCHEMBL12733119 0.74 TYR (0.64) TYRBIDMCL1BCL2L1BAK1
SCHEMBL240779 0.71 TDP1 (0.43) MAPTKDM4ECYP3A4HTTTDP1
SCHEMBL689027 0.71 TDP1 (0.43) MAPTKDM4ECYP3A4HTTTDP1
SCHEMBL7164452 0.71 TDP1 (0.43) MAPTKDM4ECYP3A4HTTTDP1
SCHEMBL5838521 0.71 TDP1 (0.43) MAPTKDM4ECYP3A4HTTTDP1

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-2015184296-A1 ANTIMICROBIAL PHARMACEUTICAL COMPOSITIONS WITH MULTIPLE DRUG RESISTANCE INHIBITING PROPERTIES FRIEDHOFF LAWRENCE T (US) 2015-12-03 — — WO disclosed
Send feedback