SCHEMBL20750985

SCHEMBL20750985

O=C(O)c1nn(CCc2cccc3ccccc23)cc(O)c1=O

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ KDM4A O75164 1/20 0.49
▸ KDM4C Q9H3R0 1/20 0.49
▸ COPS5 Q92905 1/20 0.46
▸ CMA1 P23946 3/20 0.40
▸ TDP1 Q9NUW8 1/20 0.40
▸ DAO P14920 1/20 0.40
▸ MCL1 Q07820 4/20 0.39
▸ MTNR1A P48039 1/20 0.39
▸ ADORA3 P0DMS8 1/20 0.38
▸ ADORA2A P29274 1/20 0.38
▸ ADORA2B P29275 1/20 0.38
▸ ADORA1 P30542 1/20 0.38
▸ P2RX3 P56373 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
SCHEMBL20751266 0.87 MTNR1A (0.45) KDM4AKDM4CCMA1DAOMTNR1A
SCHEMBL16578609 0.81 RAB9A (0.49) TDP1
SCHEMBL16578613 0.81 ADORA2A (0.46) KDM4AKDM4CDAOADORA3ADORA2A
SCHEMBL16578604 0.80 MEN1 (0.40) KDM4CTDP1DAO
SCHEMBL16578558 0.80 KDM4A (0.50) KDM4AKDM4CDAOMTNR1A
SCHEMBL20750987 0.79 SOX18 (0.45) ADORA3ADORA2AADORA1
SCHEMBL16578607 0.76 COMT (0.46) DAOMCL1ADORA3ADORA2AADORA1
SCHEMBL20751315 0.73 ALDH1A1 (0.34) CMA1MCL1
SCHEMBL16578557 0.72 ALDH1A1 (0.44) ADORA3
SCHEMBL16578524 0.72 MTNR1A (0.41) KDM4AKDM4CCMA1DAOMTNR1A

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-10364226-B2 Pyridazinone compounds and uses thereof ALIOS BIOPHARMA, INC. (US) 2019-07-30 — — US disclosed
EP-3030549-B1 PYRIDAZINONE COMPOUNDS AND USES THEREOF ALIOS BIOPHARMA INC (US) 2019-02-20 — — EP 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-10364226-B2 Pyridazinone compounds and uses thereof PDXK, PNPO, PLPBP KDM4A 1626/4885KDM4C 1580/4885COPS5 4274/4885

“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.

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