SCHEMBL810520

SCHEMBL810520

Nc1cc(OCc2cccc3ccccc23)ccc1Sc1ccc(O)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PARP10 Q53GL7 2/20 0.48
PARP15 Q460N3 1/20 0.47
NPC1 O15118 2/20 0.45
RAB9A P51151 2/20 0.45
LTA4H P09960 1/20 0.43
PLA2G2A P14555 1/20 0.43
MEN1 O00255 3/20 0.43
KMT2A Q03164 3/20 0.43
FFAR1 O14842 1/20 0.43
AKR1B1 P15121 1/20 0.43
PIM1 P11309 1/20 0.42
AKT2 P31751 1/20 0.42
F2 P00734 2/20 0.40
LMNA P02545 2/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2C19 P33261 1/20 0.40
RECQL P46063 1/20 0.40
SPHK2 Q9NRA0 1/20 0.38
SPHK1 Q9NYA1 1/20 0.38
SLC6A2 P23975 1/20 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
SCHEMBL810856 0.83 MAOB (0.44) MEN1KMT2APIM1AKT2LMNA
SCHEMBL810986 0.83 PIM1 (0.52) PARP10FFAR1PIM1AKT2CYP2C19
SCHEMBL811060 0.81 PARP10 (0.48) PARP10PARP15MEN1KMT2APIM1
SCHEMBL810336 0.81 FFAR1 (0.44) MEN1KMT2AFFAR1PIM1AKT2
SCHEMBL811334 0.80 CYP1A2 (0.55) PARP10RAB9AMEN1KMT2ALMNA
SCHEMBL2516394 0.78 PARP10 (0.68) PARP10PARP15NPC1RAB9ALTA4H
SCHEMBL811554 0.77 PDE10A (0.53)
SCHEMBL811071 0.76 PARP10 (0.46) PARP10NPC1RAB9APIM1AKT2
SCHEMBL811055 0.76 MRGPRX4 (0.39) NPC1RAB9APIM1AKT2LMNA
SCHEMBL811689 0.75 MAOB (0.54) PARP10

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 5 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
CN-101443334-A Anti-viral compounds ABBOTT LAB (US) 2009-05-27 CN disclosed
US-20070197558-A1 ANTI-VIRAL COMPOUNDS ABBVIE INC. 2007-08-23 US 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 PARP10 2995/4885PARP15 3286/4885NPC1 37/4885

“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.