SCHEMBL28367383

SCHEMBL28367383

CC(C)CCCCCCc1ccc(O)c(CCCCCCC(C)C)c1CCCCCCC(C)C.OP(O)O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TYR P14679 5/20 0.41
KMT2A Q03164 3/20 0.35
MAPT P10636 2/20 0.35
TDP1 Q9NUW8 2/20 0.35
MEN1 O00255 2/20 0.35
CYP3A4 P08684 2/20 0.35
TSHR P16473 2/20 0.35
TP53 P04637 1/20 0.35
ALOX5 P09917 1/20 0.35
ALOX15 P16050 1/20 0.35
HTT P42858 1/20 0.35
HIF1A Q16665 2/20 0.34
EPAS1 Q99814 2/20 0.34
KDM4E B2RXH2 2/20 0.33
ALDH1A1 P00352 2/20 0.33
GAA P10253 2/20 0.33
LMNA P02545 1/20 0.33
CYP1A2 P05177 1/20 0.32
POLB P06746 1/20 0.32
CYP2D6 P10635 1/20 0.32

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
SCHEMBL11544562 0.95 TYR (0.44) TYRKMT2AMAPTTDP1MEN1
SCHEMBL5827265 0.88 TYR (0.39) TYRKMT2AMAPTTDP1MEN1
SCHEMBL8991619 0.87 HIF1A (0.41) TYRKMT2AMAPTTDP1MEN1
SCHEMBL11238343 0.86 BID (0.39) MAPTALOX15KDM4EGAAGABRA1
SCHEMBL10709536 0.84 TYR (0.50) TYRKMT2AMAPTTDP1MEN1
SCHEMBL7074312 0.82 TYR (0.60) TYRKMT2AMAPTTDP1MEN1
SCHEMBL263227 0.82 TYR (0.60) TYRKMT2AMAPTTDP1MEN1
SCHEMBL340912 0.81 BID (0.42) TYRMAPTALOX15KDM4EGABRA1
SCHEMBL258691 0.81 BID (0.42) TYRMAPTALOX15KDM4EGABRA1
SCHEMBL258767 0.81 BID (0.42) TYRMAPTALOX15KDM4EGABRA1

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-110914390-A Polymeric multi-phosphorus lubricant additives for metal working 多佛化学制品有限公司 2020-03-24 CN disclosed