SCHEMBL930783

SCHEMBL930783

Cc1ccc(-c2cc(Cl)nc(N)n2)o1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.49
HSP90AA1 P07900 5/20 0.49
HSP90AB1 P08238 5/20 0.49
ALDH1A1 P00352 4/20 0.48
GAA P10253 4/20 0.48
MAPT P10636 4/20 0.48
PKM P14618 4/20 0.48
HPGD P15428 4/20 0.48
MEN1 O00255 3/20 0.48
ALOX12 P18054 3/20 0.48
KMT2A Q03164 3/20 0.48
GLA P06280 2/20 0.48
TSHR P16473 1/20 0.48
ADORA2A P29274 6/20 0.47
ADORA1 P30542 6/20 0.47
ALOX15 P16050 2/20 0.47
CASP1 P29466 2/20 0.47
CASP7 P55210 2/20 0.47
HSD17B10 Q99714 2/20 0.47
USP2 O75604 1/20 0.47

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
SCHEMBL929213 0.83 ALDH1A1 (0.44) KDM4EALDH1A1GAAMAPTPKM
SCHEMBL2763257 0.83 ALDH1A1 (0.44) KDM4EALDH1A1GAAMAPTPKM
SCHEMBL2763076 0.80 ALDH1A1 (0.42) KDM4EALDH1A1GAAMAPTPKM
SCHEMBL2763990 0.78 ADORA2A (0.46) KDM4EALDH1A1GAAMAPTPKM
SCHEMBL928465 0.78 ADORA2A (0.46) KDM4EALDH1A1GAAMAPTPKM
SCHEMBL930995 0.76 ALDH1A1 (0.53) KDM4EALDH1A1GAAMAPTPKM
SCHEMBL929260 0.75 ADORA2A (0.60) ADORA2AADORA1ADORA3ADORA2B
SCHEMBL2762992 0.74 ALDH1A1 (0.38) KDM4EALDH1A1GAAMAPTPKM
SCHEMBL3096890 0.73 ADORA2A (0.46) KDM4EALDH1A1GAAMAPTPKM
SCHEMBL4969679 0.73 ADORA2A (0.44) KDM4EALDH1A1GAAMAPTPKM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117924258-A Pyridone compound derivative and application thereof 复旦大学 2024-04-26 CN disclosed
US-20210355104-A1 ADENOSINE RECEPTOR BINDING COMPOUNDS NIKANG THERAPEUTICS, INC. (US) 2021-11-18 US disclosed
EP-3820474-A1 ADENOSINE RECEPTOR BINDING COMPOUNDS Nikang Therapeutics, Inc. (US) 2021-05-19 EP disclosed
CN-112423758-A Adenosine receptor binding compounds 尼康治疗公司 2021-02-26 CN disclosed
US-7875600-B2 Pyrimidine compounds as purine receptor antagonist VERNALIS (R&D) LIMITED (GB) 2011-01-25 US disclosed
US-20070281936-A1 To reducte the purinergic neurotransmission; Parkinson's disease; dyskinesias; Movement disorders; Adenosine receptors antagonists; 2-Methylamino-6-(5-methyl-2-furyl)-N-(2-pyridylmethyl)pyrimidine-4-carboxamide VERNALIS (R & D ) LIMITED (GB) 2007-12-06 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 (2 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-20210355104-A1 ADENOSINE RECEPTOR BINDING COMPOUNDS ADORA2A, ADORA1, ADORA3 KDM4E 3550/4885HSP90AA1 2718/4885HSP90AB1 2515/4885
US-20070281936-A1 To reducte the purinergic neurotransmission; Parkinson's disease; dyskinesias; Movement disorders; Adenosine receptors antagonists; 2-Methylamino-6-(5-methyl-2-furyl)-N-(2-pyridylmethyl)pyrimidine-4-carboxamide ADORA2A, ADORA3, ADORA1 KDM4E 3444/4885HSP90AA1 4430/4885HSP90AB1 4648/4885

“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.