SCHEMBL23878891

SCHEMBL23878891

COc1ccc2c(Nc3cc(C)[nH]n3)nc(N(C)C3CC4CCC(C3)N4C(=O)O)nc2c1

nearest known ligand 0.51

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ AURKA O14965 3/20 0.51
▸ AURKB Q96GD4 1/20 0.51
▸ JAK3 P52333 15/20 0.48
▸ JAK1 P23458 6/20 0.48
▸ TYK2 P29597 7/20 0.48
▸ JAK2 O60674 3/20 0.48
▸ SRC P12931 1/20 0.44
▸ GSK3B P49841 1/20 0.44

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
SCHEMBL24995838 0.90 JAK3 (0.49) AURKAAURKBJAK3JAK1TYK2
SCHEMBL30147243 0.90 JAK3 (0.49) AURKAAURKBJAK3JAK1TYK2
SCHEMBL23878805 0.84 AURKA (0.53) AURKAAURKBJAK3JAK1TYK2
SCHEMBL22055367 0.84 AURKA (0.47) AURKAAURKBJAK3JAK1TYK2
SCHEMBL23879041 0.81 JAK3 (0.47) JAK3JAK1TYK2JAK2
SCHEMBL22054211 0.81 JAK3 (0.60) AURKAAURKBJAK3JAK1TYK2
SCHEMBL23879146 0.81 JAK3 (0.60) AURKAAURKBJAK3JAK1TYK2
SCHEMBL23878775 0.81 AURKA (0.51) AURKAAURKBJAK3JAK1TYK2
SCHEMBL23878792 0.80 JAK3 (0.48) JAK3JAK1TYK2JAK2
SCHEMBL23878857 0.80 JAK1 (0.51) JAK3JAK1TYK2JAK2

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-20230043863-A1 HETEROAROMATIC DERIVATIVES FOR USE AS REGULATOR, PREPARATION METHOD THEREFOR AND USE THEREOF SHANGHAI HANSOH BIOMEDICAL CO., LTD. (CN) 2023-02-09 — — US disclosed
EP-3889152-A1 HETEROAROMATIC DERIVATIVES FOR USE AS REGULATOR, PREPARATION METHOD THEREFOR AND USE THEREOF Jiangsu Hansoh Pharmaceutical Group Co., Ltd. (CN) 2021-10-06 — — EP 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-20230043863-A1 HETEROAROMATIC DERIVATIVES FOR USE AS REGULATOR, PREPARATION METHOD THEREFOR AND USE THEREOF WEE2, WEE1, RORB AURKA 1417/4885AURKB 584/4885JAK3 88/4885

“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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