SCHEMBL3035403

SCHEMBL3035403

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

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KDM4A O75164 1/20 0.41
KDM4B O94953 1/20 0.41
KDM5C P41229 1/20 0.41
KDM5B Q9UGL1 1/20 0.41
NPC1 O15118 1/20 0.40
MAPK1 P28482 1/20 0.40
EGLN1 Q9GZT9 8/20 0.37
TNKS O95271 3/20 0.36
TNKS2 Q9H2K2 3/20 0.36
PARP2 Q9UGN5 2/20 0.36
PARP1 P09874 6/20 0.36
GUSB P08236 1/20 0.35
KDM4E B2RXH2 1/20 0.35
CYP1A2 P05177 1/20 0.35
CYP2D6 P10635 1/20 0.35
CYP2C9 P11712 1/20 0.35
CYP2C19 P33261 1/20 0.35

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
SCHEMBL3040246 0.84 PARP1 (0.43) KDM4AKDM4BKDM5CKDM5BNPC1
SCHEMBL3040436 0.84 PARP1 (0.56) TNKSTNKS2PARP2PARP1
SCHEMBL3025074 0.84 PARP1 (0.54) KDM4AKDM4BKDM5CKDM5BNPC1
SCHEMBL3039605 0.81 EGLN1 (0.43) KDM4AKDM4BKDM5CKDM5BNPC1
SCHEMBL3030437 0.77 HTR3A (0.52) NPC1MAPK1EGLN1TNKSTNKS2
SCHEMBL3036576 0.75 EGLN1 (0.58) EGLN1
SCHEMBL3027794 0.75 TUBB4A (0.48) KDM4AKDM4BKDM5CKDM5BNPC1
SCHEMBL3025380 0.75 AURKA (0.38) KDM4AKDM4BKDM5CKDM5BNPC1
SCHEMBL16857710 0.73 EGLN1 (0.40) EGLN1GUSB
SCHEMBL2555865 0.73 ADORA2A (0.49) KDM4AKDM4BKDM5CKDM5BEGLN1

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 KDM4A 797/4885KDM4B 1172/4885KDM5C 652/4885

“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.