SCHEMBL17263308

SCHEMBL17263308

CC(=O)c1cc(C(C)=O)cc(C(=O)c2ccc(Oc3ccc(Oc4ccc(C)cc4)cc3)cc2)c1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.60
RAB9A P51151 2/20 0.60
HPGD P15428 2/20 0.60
LMNA P02545 4/20 0.55
ALDH1A1 P00352 3/20 0.55
MMP13 P45452 2/20 0.53
MAOB P27338 1/20 0.49
SRD5A2 P31213 2/20 0.48
HSD17B1 P14061 1/20 0.46
HSD17B2 P37059 1/20 0.46
ESRRA P11474 1/20 0.45
SMN1; SMN2 Q16637 3/20 0.44
MAPK1 P28482 2/20 0.44
NPC1 O15118 1/20 0.44
STAT3 P40763 1/20 0.44
STAT1 P42224 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
KMT2A Q03164 2/20 0.44
HTT P42858 1/20 0.44
CNR1 P21554 1/20 0.44

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
SCHEMBL9999840 0.91 HPGD (0.73) MAPTRAB9AHPGDLMNAALDH1A1
SCHEMBL10014129 0.91 HPGD (0.73) MAPTRAB9AHPGDLMNAALDH1A1
SCHEMBL9999837 0.91 HPGD (0.73) MAPTRAB9AHPGDLMNAALDH1A1
SCHEMBL10014131 0.91 HPGD (0.73) MAPTRAB9AHPGDLMNAALDH1A1
SCHEMBL12062003 0.91 HPGD (0.73) MAPTRAB9AHPGDLMNAALDH1A1
SCHEMBL16995927 0.91 HPGD (0.73) MAPTRAB9AHPGDLMNAALDH1A1
SCHEMBL9999839 0.91 HPGD (0.73) MAPTRAB9AHPGDLMNAALDH1A1
SCHEMBL760749 0.89 RAB9A (0.55) MAPTRAB9AHPGDLMNAALDH1A1
SCHEMBL15624800 0.89 RAB9A (0.55) MAPTRAB9AHPGDLMNAALDH1A1
SCHEMBL29285258 0.87 HPGD (0.67) MAPTRAB9AHPGDLMNAALDH1A1

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
US-9187604-B1 Hyperbranched poly(ether-ketones) via an A3 + B2 polymerization method THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY OF THE AIR FORCE (US) 2015-11-17 US disclosed