SCHEMBL30009600

SCHEMBL30009600

O=C(Nc1ccc(-c2ncnc3[nH]ccc23)cc1)Nc1ccc(F)c(F)c1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LIMK1 P53667 4/20 0.61
JAK1 P23458 3/20 0.61
ROCK2 O75116 3/20 0.61
CYP3A4 P08684 1/20 0.61
CYP3A5 P20815 1/20 0.61
JAK3 P52333 6/20 0.56
KDR P35968 5/20 0.56
FGFR1 P11362 3/20 0.56
FLT1 P17948 3/20 0.56
JAK2 O60674 3/20 0.56
BTK Q06187 3/20 0.56
AURKA O14965 2/20 0.56
DAPK3 O43293 2/20 0.56
PRKD3 O94806 2/20 0.56
MAP4K4 O95819 2/20 0.56
PAK4 O96013 2/20 0.56
NTRK1 P04629 2/20 0.56
CSF1R P07333 2/20 0.56
RET P07949 2/20 0.56
IGF1R P08069 2/20 0.56

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
SCHEMBL30009111 0.88 ROCK2 (0.60) LIMK1JAK1ROCK2CYP3A4CYP3A5
SCHEMBL28871098 0.80 CIT (0.63) LIMK1JAK1ROCK2CYP3A4CYP3A5
SCHEMBL30009442 0.79 CIT (0.62) LIMK1JAK1ROCK2CYP3A4CYP3A5
SCHEMBL30008743 0.78 KIT (0.57) LIMK1JAK1ROCK2CYP3A4CYP3A5
SCHEMBL30009814 0.77 KIT (0.70) JAK3KDRFGFR1FLT1JAK2
SCHEMBL20917967 0.76 JAK1 (1.00) JAK1
SCHEMBL3127395 0.76 ROCK2 (1.00) LIMK1ROCK2CYP3A4CYP3A5JAK3
SCHEMBL28345572 0.76 JAK3 (0.74) LIMK1JAK1ROCK2CYP3A4CYP3A5
SCHEMBL30009617 0.75 JAK1 (0.63) LIMK1JAK1ROCK2CYP3A4CYP3A5
SCHEMBL29291567 0.75 CIT (0.57) LIMK1JAK1ROCK2CYP3A4CYP3A5

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-11524968-B2 Heterocyclic compound as a protein kinase inhibitor HK INNO.N CORPORATION (KR) 2022-12-13 US claimed

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-11524968-B2 Heterocyclic compound as a protein kinase inhibitor MAP3K20, MAP3K15, MAP3K1 LIMK1 591/4885JAK1 83/4885ROCK2 466/4885

“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.