SCHEMBL26008693

SCHEMBL26008693

CC(=O)c1cc(Br)c(=O)[nH]n1

nearest known ligand 0.37

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 10/20 0.37
DAO P14920 1/20 0.37
HCAR3 P49019 2/20 0.34
MAPK1 P28482 1/20 0.34
THRA P10827 3/20 0.33
THRB P10828 3/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
DYRK1A Q13627 1/20 0.31
CYTH3 O43739 1/20 0.31
BTK Q06187 1/20 0.31
EPN1 Q9Y6I3 1/20 0.31
POLB P06746 1/20 0.31
ALDH1A1 P00352 1/20 0.31

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
SCHEMBL30991131 0.82 HCAR2 (0.52) HCAR2DAOHCAR3CYTH3BTK
SCHEMBL20606968 0.81 MAP2K1 (0.37) HCAR2DAOHCAR3MAPK1THRA
SCHEMBL15633292 0.80 MAPK1 (0.59) HCAR2MAPK1NPC1RAB9APOLB
SCHEMBL8299784 0.73 THRA (0.39) HCAR2DAOTHRATHRBNPC1
SCHEMBL4035315 0.71
SCHEMBL2629428 0.71
SCHEMBL12011328 0.71 MAPK1 (0.52) HCAR2DAOHCAR3MAPK1CYTH3
SCHEMBL20743794 0.71
SCHEMBL12270026 0.69
SCHEMBL6212668 0.69

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-20230265075-A1 6-HETEROARYLOXY BENZIMIDAZOLES AND AZABENZIMIDAZOLES AS JAK2 INHIBITORS AJAX THERAPEUTICS, INC. 2023-08-24 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-20230265075-A1 6-HETEROARYLOXY BENZIMIDAZOLES AND AZABENZIMIDAZOLES AS JAK2 INHIBITORS JAK2, JAK3, STAT5B HCAR2 2637/4885DAO 1306/4885HCAR3 2505/4885

“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.