SCHEMBL3040246

SCHEMBL3040246

O=c1[nH]c(-n2cccn2)nc2c(F)cccc12

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 5/20 0.43
TNKS O95271 4/20 0.43
TNKS2 Q9H2K2 4/20 0.43
KDM4A O75164 1/20 0.41
KDM4B O94953 1/20 0.41
KDM5C P41229 1/20 0.41
KDM5B Q9UGL1 1/20 0.41
ADORA2A P29274 1/20 0.41
JAK2 O60674 1/20 0.40
TYK2 P29597 1/20 0.40
EGLN1 Q9GZT9 7/20 0.40
NPC1 O15118 1/20 0.40
MAPK1 P28482 1/20 0.40
PARP2 Q9UGN5 2/20 0.40
KCNH2 Q12809 1/20 0.37

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
SCHEMBL3025074 0.84 PARP1 (0.54) PARP1TNKSTNKS2KDM4AKDM4B
SCHEMBL3040436 0.84 PARP1 (0.56) PARP1TNKSTNKS2PARP2
SCHEMBL3035403 0.84 KDM4A (0.41) PARP1TNKSTNKS2KDM4AKDM4B
SCHEMBL3039605 0.81 EGLN1 (0.43) PARP1TNKSTNKS2KDM4AKDM4B
SCHEMBL1193169 0.80 EGLN1 (0.55) ADORA2AJAK2TYK2EGLN1NPC1
SCHEMBL3030437 0.77 HTR3A (0.52) PARP1TNKSTNKS2EGLN1NPC1
SCHEMBL3025607 0.75 EGLN1 (0.73) EGLN1
SCHEMBL13362757 0.75 MGLL (0.47) PARP1TNKSTNKS2NPC1
SCHEMBL3030884 0.75 TUBB4A (0.48) PARP1TNKSTNKS2EGLN1MAPK1
SCHEMBL3025673 0.75 EGLN1 (0.43) TNKSTNKS2EGLN1NPC1MAPK1

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-8937078-B2 Quinazolinones as prolyl hydroxylase inhibitors JANSSEN PHARMACEUTICA NV (BE) 2015-01-20 US disclosed
US-20100204226-A1 QUINAZOLINONES AS PROLYL HYDROXYLASE INHIBITORS JANSSEN PHARMACEUTICA NV (BE) 2010-08-12 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-20100204226-A1 QUINAZOLINONES AS PROLYL HYDROXYLASE INHIBITORS P4HA1, EGLN3, EGLN2 PARP1 637/4885TNKS 984/4885TNKS2 1259/4885

“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.