SCHEMBL31290967

SCHEMBL31290967

CNc1nc2ccc(Oc3ccc(F)c(N)c3)nc2s1

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ BRAF P15056 2/20 0.47
▸ MAP4K4 O95819 6/20 0.41
▸ HCK P08631 2/20 0.41
▸ BTK Q06187 2/20 0.41
▸ KDR P35968 3/20 0.38
▸ PDGFRB P09619 1/20 0.35
▸ KIT P10721 1/20 0.35
▸ FLT1 P17948 1/20 0.35
▸ GCK P35557 3/20 0.33
▸ NR4A1 P22736 1/20 0.31
▸ LDHA P00338 1/20 0.31
▸ MAPT P10636 2/20 0.31
▸ KDM4E B2RXH2 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ NPC1 O15118 1/20 0.30
▸ TP53 P04637 1/20 0.30
▸ HTT P42858 1/20 0.30
▸ RAB9A P51151 1/20 0.30
▸ SMN1; SMN2 Q16637 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
SCHEMBL24885518 1.00 BRAF (0.47) BRAFMAP4K4HCKBTKKDR
SCHEMBL24885915 0.87 BRAF (0.55) BRAFMAP4K4HCKBTKKDR
SCHEMBL2855636 0.85 BRAF (0.54) BRAFKDRPDGFRBKITFLT1
SCHEMBL2453008 0.81 BRAF (0.69) BRAFKDRPDGFRBKITFLT1
SCHEMBL15946928 0.73 BRAF (0.67) BRAFKDRPDGFRBKITFLT1
SCHEMBL2856446 0.72 DYRK1A (0.46) BRAFNPC1HTTRAB9ASMN1; SMN2
SCHEMBL2858936 0.72 DYRK1A (0.46) BRAFKDRPDGFRBKITFLT1
SCHEMBL14705755 0.72 BRAF (0.54) BRAFMAP4K4HCKBTKKDR
SCHEMBL14243031 0.72 LCK (0.41) HCKBTKGCKLDHAMAPT
SCHEMBL2851409 0.70 BRAF (0.62) BRAFKDRPDGFRBKITFLT1

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-20240400577-A1 MODULATORS OF PROTEIN KINASES VIBLIOME THERAPEUTICS, LLC 2024-12-05 — — 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-20240400577-A1 MODULATORS OF PROTEIN KINASES MAP3K20, PRKCE, PRKCH BRAF 141/4885MAP4K4 64/4885HCK 472/4885

“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.

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