SCHEMBL25680888

SCHEMBL25680888

Brc1cnc(I)c2[nH]ccc12

nearest known ligand 0.40

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PRKCI P41743 3/20 0.40
AHR P35869 1/20 0.34
PARP1 P09874 1/20 0.32
MAPK1 P28482 1/20 0.32
ZAP70 P43403 1/20 0.30
CLK1 P49759 1/20 0.30
CDK5 Q00535 1/20 0.30
CDK5R1 Q15078 1/20 0.30
AXL P30530 1/20 0.30

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
SCHEMBL31275318 0.80 PRKCI (0.42) PRKCIAHRPARP1MAPK1ZAP70
SCHEMBL2211568 0.80 PRKCI (0.42) PRKCIAHRPARP1MAPK1ZAP70
SCHEMBL2674588 0.77 PIK3C3 (0.41) PRKCIAHRPARP1MAPK1ZAP70
SCHEMBL31279052 0.77 DYRK1A (0.44) PRKCIAHRPARP1MAPK1ZAP70
SCHEMBL1763755 0.77 DYRK1A (0.44) PRKCIAHRPARP1MAPK1ZAP70
SCHEMBL21986162 0.77 AXL (0.44) PRKCIAXL
SCHEMBL12033234 0.73 PRKCI (0.41) PRKCIAHRAXL
SCHEMBL16336384 0.73 PRKCI (0.37) PRKCIAHR
SCHEMBL16916862 0.73 PRKCI (0.37) PRKCIAHRAXL
SCHEMBL31638924 0.73 PRKCI (0.37) PRKCIAHR

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-11685746-B2 Heteroaryl compounds for treating Huntington's disease PTC THERAPEUTICS, INC. (US) 2023-06-27 US disclosed
US-11685746-B2 Heteroaryl compounds for treating Huntington's disease PTC THERAPEUTICS, INC. (US) 2023-06-27 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-11685746-B2 Heteroaryl compounds for treating Huntington's disease HTT, HYPK, HDAC6 PRKCI 4354/4885AHR 199/4885PARP1 3328/4885

“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.