SCHEMBL31707397

SCHEMBL31707397

CC(C)(C)OC(=O)Nc1ccncc1Br

nearest known ligand 0.51

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 2/20 0.47
CYP17A1 P05093 4/20 0.46
BCHE P06276 1/20 0.46
ACHE P22303 1/20 0.46
RAB9A P51151 2/20 0.43
METAP1 P53582 1/20 0.41
BRS3 P32247 1/20 0.41
NPC1 O15118 1/20 0.40
ATR Q13535 1/20 0.40
CYP3A4 P08684 1/20 0.39

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
SCHEMBL4827917 1.00 NAMPT (0.47) NAMPTCYP17A1BCHEACHERAB9A
SCHEMBL30114700 0.88 NAMPT (0.47) NAMPTCYP17A1RAB9AMETAP1BRS3
SCHEMBL18522430 0.86 NAMPT (0.50) NAMPTCYP17A1RAB9AMETAP1BRS3
SCHEMBL27693409 0.85 RAB9A (0.44) NAMPTCYP17A1BCHEACHERAB9A
SCHEMBL1128597 0.84 BCHE (0.49) BCHEACHERAB9ANPC1
SCHEMBL2107971 0.83 NAMPT (0.48) NAMPTCYP17A1RAB9AMETAP1BRS3
SCHEMBL3666785 0.83 NAMPT (0.48) NAMPTCYP17A1RAB9AMETAP1BRS3
SCHEMBL5746021 0.82 NAMPT (0.47) NAMPTCYP17A1RAB9A
SCHEMBL741240 0.82 NAMPT (0.47) NAMPTCYP17A1RAB9AMETAP1BRS3
SCHEMBL15039524 0.82 CYP17A1 (0.55) NAMPTCYP17A1RAB9AMETAP1BRS3

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-12448379-B2 Wild type kit inhibitors BLUEPRINT MEDICINES CORPORATION (US) 2025-10-21 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-12448379-B2 Wild type kit inhibitors KIT, TNK1, TNNI3K NAMPT 2003/4885CYP17A1 1372/4885BCHE 2804/4885

“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.