SCHEMBL25316908

SCHEMBL25316908

CN1[C]=NC=C(c2ccc3cc(Oc4ccnc(Br)c4)ccc3n2)C1O

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ BRAF P15056 4/20 0.32
▸ RAF1 P04049 1/20 0.30
▸ SCN7A Q01118 1/20 0.30
▸ KCNH2 Q12809 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
SCHEMBL25913446 0.69 MAOA (0.35) BRAFRAF1SCN7AKCNH2
SCHEMBL25913399 0.68 CSF1R (0.39) BRAFRAF1
SCHEMBL25914740 0.66 CSF1R (0.35) BRAFRAF1
SCHEMBL25911790 0.65 CSF1R (0.53) BRAFRAF1
SCHEMBL25914331 0.63 DYRK1A (0.35) BRAF
SCHEMBL25314973 0.62 BRAF (0.42) BRAFRAF1
SCHEMBL25914665 0.62 CSF1R (0.39) BRAFRAF1
SCHEMBL25912751 0.62 MAPK8 (0.39) BRAF
SCHEMBL30467033 0.61 BRAF (0.35) BRAF
SCHEMBL25913001 0.61 BRAF (0.35) BRAF

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
WO-2023125812-A1 SUBSTITUTED PYRIMIDONE DERIVATIVE, AND PHARMACEUTICAL COMPOSITION AND MEDICAL USE THEREOF 上海海雁医药科技有限公司 2023-07-06 — — WO disclosed
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