SCHEMBL6538511

SCHEMBL6538511

Cc1cc(-c2ccc(=O)[nH]c2-c2ccccc2)nn(C(C)C)c1=O

nearest known ligand 0.38

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PDE1A P54750 1/20 0.38
PDE1B Q01064 1/20 0.38
PDE1C Q14123 1/20 0.38
PDE10A Q9Y233 7/20 0.36
KDM4E B2RXH2 3/20 0.36
ALDH1A1 P00352 2/20 0.36
TP53 P04637 1/20 0.36
HPGD P15428 1/20 0.36
HSD17B10 Q99714 1/20 0.36
POLB P06746 1/20 0.36
P2RY6 Q15077 1/20 0.36
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
GAA P10253 1/20 0.34
MAPT P10636 1/20 0.34
AURKA O14965 1/20 0.34
AURKB Q96GD4 1/20 0.34
BRD4 O60885 1/20 0.33
EGFR P00533 1/20 0.33

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
SCHEMBL6538758 0.81 PDE10A (0.38) PDE10AKDM4EALDH1A1TP53POLB
SCHEMBL6539035 0.75 PDE1A (0.42) PDE1APDE1BPDE1CPDE10AKDM4E
SCHEMBL6538527 0.70 PDE10A (0.40) PDE10ABRD4
SCHEMBL6539134 0.70 BRD4 (0.39) PDE10AALDH1A1GAABRD4EGFR
SCHEMBL6539040 0.69 PDE10A (0.40) PDE10AKDM4EALDH1A1RAB9ABRD4
SCHEMBL6539217 0.69 ADORA2A (0.48) PDE10A
SCHEMBL6539121 0.68 PDE10A (0.45) PDE10AKDM4EHSD17B10POLB
SCHEMBL11257143 0.68 GSK3B (0.43) TP53POLBMAPTAURKAAURKB
SCHEMBL2922398 0.68 PDE10A (0.52) PDE10AKDM4EALDH1A1HPGDHSD17B10
SCHEMBL6538958 0.67 HCAR1 (0.32) PDE10ATP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040067955-A1 Pyridazinone compound and pharmaceutical use thereof FUJISAWA PHARMACEUTICAL CO. LTD. (JP) 2004-04-08 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-20040067955-A1 Pyridazinone compound and pharmaceutical use thereof ADORA1, ADORA2A, P2RX5 PDE1A 391/4885PDE1B 415/4885PDE1C 524/4885

“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.