SCHEMBL273167

SCHEMBL273167

O=Nc1cccc(-c2nc3ccc(O)cc3c(=O)[nH]2)c1

nearest known ligand 0.51

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GUSB P08236 5/20 0.51
TNKS O95271 4/20 0.51
PARP1 P09874 4/20 0.51
TNKS2 Q9H2K2 4/20 0.51
NPC1 O15118 1/20 0.48
RAB9A P51151 1/20 0.48
KDM4C Q9H3R0 1/20 0.44
PLA2G2A P14555 1/20 0.43
PTGS2 P35354 1/20 0.43
HPGD P15428 2/20 0.43
CYP1A1 P04798 2/20 0.43
CYP1B1 Q16678 2/20 0.43
ALDH1A1 P00352 1/20 0.43
MAPT P10636 1/20 0.43
ALOX15 P16050 1/20 0.43
HSD17B10 Q99714 1/20 0.43
APOBEC3G Q9HC16 1/20 0.43
CYP1A2 P05177 1/20 0.43

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
SCHEMBL277870 0.85 TNKS (0.56) GUSBTNKSPARP1TNKS2NPC1
SCHEMBL11920135 0.82 KDM4E (0.54) GUSBTNKSPARP1TNKS2NPC1
SCHEMBL277606 0.78 MET (0.47) TNKSPARP1TNKS2NPC1RAB9A
SCHEMBL259489 0.78 GUSB (0.74) GUSBTNKSPARP1TNKS2NPC1
SCHEMBL11919793 0.78 GUSB (0.55) GUSBTNKSTNKS2NPC1RAB9A
SCHEMBL12811999 0.77 PARP1 (0.47) GUSBTNKSPARP1TNKS2HPGD
SCHEMBL259248 0.76 TNKS (0.58) GUSBTNKSPARP1TNKS2NPC1
SCHEMBL873906 0.76 TNKS (0.71) GUSBTNKSPARP1TNKS2NPC1
SCHEMBL259542 0.74 KDM4E (0.56) GUSBTNKSPARP1TNKS2NPC1
SCHEMBL11919210 0.74 GUSB (0.50) GUSBTNKSTNKS2CYP1A1CYP1B1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8067586-B2 Fused heteroaryl derivatives ASTELLAS PHARMA INC. (JP) 2011-11-29 US disclosed
US-20100137584-A1 FUSED HETEROARYL DERIVATIVES HAYAKAWA MASAHIKO 2010-06-03 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-20100137584-A1 FUSED HETEROARYL DERIVATIVES PIK3CD, PIK3R3, PIK3C2A GUSB 1751/4885TNKS 578/4885PARP1 1165/4885

“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.