SCHEMBL20785166

SCHEMBL20785166

O=C(c1nc(Cl)nc2cc(Cl)sc12)N1CCCC1

nearest known ligand 0.47

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HPGD P15428 3/20 0.47
ALDH1A1 P00352 1/20 0.47
TP53 P04637 1/20 0.42
ADORA2B P29275 6/20 0.41
ADORA2A P29274 11/20 0.41
ADORA3 P0DMS8 7/20 0.41
ADORA1 P30542 4/20 0.41
MAPT P10636 1/20 0.40

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
SCHEMBL20785358 0.83 ADORA2B (0.42) HPGDALDH1A1TP53ADORA2BADORA2A
SCHEMBL20784800 0.77 DAO (0.39) HPGDALDH1A1ADORA2BADORA2AMAPT
SCHEMBL21769044 0.72 POLB (0.43) HPGDALDH1A1TP53ADORA2BADORA2A
SCHEMBL20785200 0.70 ADORA2B (0.58) ADORA2BADORA2AADORA3ADORA1
SCHEMBL20784422 0.70 ADORA2B (0.58) ADORA2BADORA2AADORA3ADORA1
SCHEMBL20785461 0.69 GLP1R (0.44) HPGDALDH1A1TP53MAPT
SCHEMBL20784412 0.69 CNR1 (0.36) ALDH1A1ADORA2BADORA2A
SCHEMBL20772237 0.69 HPGD (0.47) HPGDALDH1A1TP53MAPT
SCHEMBL21768831 0.69 POLB (0.40) HPGDALDH1A1ADORA2BADORA2AADORA3
SCHEMBL1780319 0.66 ADORA2A (0.33) ADORA2AADORA1

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-11254686-B1 Compounds and methods for modulating adenosine A2B receptor and adenosine A2A receptor CORVUS PHARMACEUTICALS, INC. (US) 2022-02-22 US disclosed
WO-2019046784-A1 COMPOUNDS AND METHODS FOR MODULATING ADENOSINE A2B RECEPTOR AND ADENOSINE A2A RECEPTOR CORVUS PHARMACEUTICALS, INC. (US) 2019-03-07 WO 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-11254686-B1 Compounds and methods for modulating adenosine A2B receptor and adenosine A2A receptor ADORA2A, ADORA2B, ADORA3 HPGD 1246/4885ALDH1A1 665/4885TP53 4094/4885

“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.