SCHEMBL31045142

SCHEMBL31045142

Cc1ccc(-c2nc(Cl)c3cc(C)sc3n2)o1

nearest known ligand 0.50

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ADORA2A P29274 16/20 0.50
ADORA1 P30542 15/20 0.50
ADORA3 P0DMS8 2/20 0.42
KDM4E B2RXH2 2/20 0.37
ALDH1A1 P00352 1/20 0.37

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
SCHEMBL11840113 0.82 SLC2A1 (0.42) ADORA2AADORA1KDM4EALDH1A1
SCHEMBL5128327 0.80 KDM4E (0.38) ADORA2AADORA1KDM4EALDH1A1
SCHEMBL31044817 0.80 FLT3 (0.54) ADORA2AADORA1ADORA3KDM4EALDH1A1
SCHEMBL31045002 0.78 MAPT (0.36) ADORA2AADORA1KDM4EALDH1A1
SCHEMBL2307822 0.76 ADORA2A (0.62) ADORA2AADORA1
SCHEMBL31045057 0.76 FLT3 (0.41) ADORA3KDM4EALDH1A1
SCHEMBL20668057 0.76 LMNA (0.50) ADORA2AADORA1ADORA3KDM4EALDH1A1
SCHEMBL31044888 0.75 KDM4E (0.33) ADORA2AADORA1KDM4EALDH1A1
SCHEMBL31045332 0.75 FLT3 (0.37) ADORA2AADORA1KDM4EALDH1A1
SCHEMBL31045371 0.75 FLT3 (0.55) ADORA2AADORA1KDM4EALDH1A1

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-20240279236-A1 COMPOUNDS AND METHODS OF TREATING TUBERCULOSIS FIMBRION THERAPEUTICS, INC. (US) 2024-08-22 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-20240279236-A1 COMPOUNDS AND METHODS OF TREATING TUBERCULOSIS G6PD, SDHA, NQO1 ADORA2A 2408/4885ADORA1 3648/4885ADORA3 3461/4885

“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.