SCHEMBL30486131

SCHEMBL30486131

O=C(Nc1ccc(Oc2ccnc3[nH]cc(Cl)c23)cc1F)Nc1cc(C2CC2)nn1-c1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
BRAF P15056 14/20 0.55
KCNJ6 P48051 5/20 0.50
KCNJ3 P48549 5/20 0.50
KCNJ5 P48544 3/20 0.50
HCK P08631 1/20 0.47
SRC P12931 1/20 0.47
MAPK14 Q16539 1/20 0.47

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
SCHEMBL25246469 1.00 BRAF (0.55) BRAFKCNJ6KCNJ3KCNJ5HCK
SCHEMBL30486127 0.88 BRAF (0.58) BRAFMAPK14
SCHEMBL25426339 0.88 BRAF (0.58) BRAFMAPK14
SCHEMBL25796308 0.86 BRAF (0.52) BRAF
SCHEMBL30486143 0.86 BRAF (0.73) BRAFMAPK14
SCHEMBL25243132 0.86 BRAF (0.73) BRAFMAPK14
SCHEMBL25286259 0.84 KCNJ6 (0.58) BRAFKCNJ6KCNJ3KCNJ5
SCHEMBL30486169 0.84 KCNJ6 (0.58) BRAFKCNJ6KCNJ3KCNJ5
SCHEMBL28685998 0.83 BRAF (0.76) BRAFHCKSRCMAPK14
SCHEMBL31193650 0.82 BRAF (0.69) BRAFMAPK14

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-20240400551-A1 NEK7 INHIBITORS HALIA THERAPEUTICS INC (US) 2024-12-05 US disclosed
US-20230210853-A1 TARGETED NEK7 INHIBITION FOR MODULATION OF THE NLRP3 INFLAMMASOME Halia Therapeutics, Inc. 2023-07-06 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 (2 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-20230210853-A1 TARGETED NEK7 INHIBITION FOR MODULATION OF THE NLRP3 INFLAMMASOME NEK7, NLRP3, NOD1 BRAF 1615/4885KCNJ6 2508/4885KCNJ3 2397/4885
US-20240400551-A1 NEK7 INHIBITORS NEK7, NEK5, NEK1 BRAF 1372/4885KCNJ6 1695/4885KCNJ3 1403/4885

“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.