SCHEMBL30008743

SCHEMBL30008743

O=C(Nc1ccc(-c2ncnc3[nH]ccc23)cc1)NC1CC1

nearest known ligand 0.57

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KIT P10721 2/20 0.57
CIT O14578 1/20 0.55
ROCK2 O75116 1/20 0.54
CYP3A4 P08684 1/20 0.54
CYP3A5 P20815 1/20 0.54
LIMK1 P53667 1/20 0.54
RET P07949 2/20 0.51
JAK2 O60674 1/20 0.50
IKBKB O14920 1/20 0.50
CHUK O15111 1/20 0.50
JAK3 P52333 4/20 0.49
MELK Q14680 1/20 0.49
JAK1 P23458 3/20 0.47
BTK Q06187 6/20 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
SCHEMBL29291567 0.83 CIT (0.57) CITROCK2CYP3A4CYP3A5LIMK1
SCHEMBL30009111 0.81 ROCK2 (0.60) KITCITROCK2CYP3A4CYP3A5
SCHEMBL28871098 0.81 CIT (0.63) KITCITROCK2CYP3A4CYP3A5
SCHEMBL30009593 0.81 RAB9A (0.51) CITROCK2CYP3A4CYP3A5LIMK1
SCHEMBL30009442 0.80 CIT (0.62) KITCITROCK2CYP3A4CYP3A5
SCHEMBL20917947 0.78 JAK1 (0.78) JAK1
SCHEMBL30009600 0.78 LIMK1 (0.61) KITCITROCK2CYP3A4CYP3A5
SCHEMBL24121895 0.77 CIT (0.53) KITCITROCK2CYP3A4CYP3A5
SCHEMBL28345572 0.77 JAK3 (0.74) KITCITROCK2CYP3A4CYP3A5
SCHEMBL30009617 0.76 JAK1 (0.63) KITCITROCK2CYP3A4CYP3A5

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-11524968-B2 Heterocyclic compound as a protein kinase inhibitor HK INNO.N CORPORATION (KR) 2022-12-13 US claimed
US-11524968-B2 Heterocyclic compound as a protein kinase inhibitor HK INNO.N CORPORATION (KR) 2022-12-13 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-11524968-B2 Heterocyclic compound as a protein kinase inhibitor MAP3K20, MAP3K15, MAP3K1 KIT 3668/4885CIT 417/4885ROCK2 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.