SCHEMBL810346

SCHEMBL810346

COc1cccc(Sc2cc(C)cc(Nc3ncnc4nc(SCc5ccccc5)ncc34)c2)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.40
LMNA P02545 3/20 0.40
TP53 P04637 3/20 0.39
RAB9A P51151 4/20 0.39
NPC1 O15118 3/20 0.39
SMN1; SMN2 Q16637 3/20 0.39
KMT2A Q03164 2/20 0.39
KDM4E B2RXH2 2/20 0.39
ALDH1A1 P00352 2/20 0.39
HPGD P15428 2/20 0.39
TDP1 Q9NUW8 2/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
GAA P10253 1/20 0.39
NFKB1 P19838 1/20 0.39
NFKB2 Q00653 1/20 0.39
RELA Q04206 1/20 0.39
EGFR P00533 6/20 0.38
ERBB2 P04626 1/20 0.38
CLK4 Q9HAZ1 2/20 0.38
ABCG2 Q9UNQ0 2/20 0.38

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
SCHEMBL811092 0.92 MAPT (0.40) MAPTLMNATP53RAB9ANPC1
SCHEMBL811839 0.90 RAB9A (0.39) MAPTLMNARAB9ANPC1SMN1; SMN2
SCHEMBL811425 0.81 EGFR (0.41) MAPTLMNARAB9ANPC1SMN1; SMN2
SCHEMBL810145 0.77 PIM1 (0.39) MAPTLMNARAB9ANPC1SMN1; SMN2
SCHEMBL811196 0.76 PIM1 (0.45) MAPTLMNATP53RAB9ANPC1
SCHEMBL810609 0.75 MAPT (0.41) MAPTLMNATP53RAB9ANPC1
SCHEMBL811189 0.74 PIM1 (0.42) MAPTLMNARAB9ANPC1SMN1; SMN2
SCHEMBL810146 0.74 METAP2 (0.40) MAPTLMNATP53RAB9ANPC1
SCHEMBL810905 0.73 PIM1 (0.42) MAPTLMNARAB9ANPC1SMN1; SMN2
SCHEMBL811281 0.72 PIM1 (0.43) MAPTTP53RAB9ANPC1SMN1; SMN2

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1971611-B1 ANTI-VIRAL COMPOUNDS ABBOTT LAB (US) 2012-10-10 EP disclosed
EP-2345652-A1 Antiviral compounds Abbott Laboratories (US) 2011-07-20 EP disclosed
US-7915411-B2 Anti-viral compounds ABBOTT LABORATORIES (US) 2011-03-29 US disclosed
EP-1971611-A1 ANTI-VIRAL COMPOUNDS Abbott Laboratories (US) 2008-09-24 EP disclosed
US-20070197558-A1 ANTI-VIRAL COMPOUNDS ABBVIE INC. 2007-08-23 US disclosed
WO-2007081517-A2 ANTI-VIRAL COMPOUNDS ABBOTT LABORATORIES (US) 2007-07-19 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20070197558-A1 ANTI-VIRAL COMPOUNDS HAVCR2, MAVS, EIF2AK2 MAPT 1347/4885LMNA 3252/4885TP53 465/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.