SCHEMBL23878768

SCHEMBL23878768

Cc1cc(Nc2nc(NC3CC4CCC(C3)N4C(=O)O)nc3cc(Cl)ccc23)n[nH]1

nearest known ligand 0.52

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ AURKA O14965 3/20 0.52
▸ PAK4 O96013 11/20 0.51
▸ NTRK1 P04629 2/20 0.50
▸ NTRK3 Q16288 1/20 0.50
▸ NTRK2 Q16620 1/20 0.50
▸ TYK2 P29597 3/20 0.49
▸ JAK3 P52333 3/20 0.49
▸ JAK2 O60674 2/20 0.49
▸ JAK1 P23458 2/20 0.49
▸ PAK1 Q13153 1/20 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
SCHEMBL23879073 0.90 NTRK1 (0.50) AURKAPAK4NTRK1TYK2JAK3
SCHEMBL23878992 0.90 AURKA (0.59) AURKANTRK1TYK2JAK3JAK2
SCHEMBL22054197 0.89 GPR119 (0.52) AURKAPAK4NTRK1NTRK3NTRK2
SCHEMBL22054006 0.89 TYK2 (0.60) AURKAPAK4NTRK1NTRK3NTRK2
SCHEMBL30147224 0.89 GPR119 (0.52) AURKAPAK4NTRK1NTRK3NTRK2
SCHEMBL23878805 0.88 AURKA (0.53) AURKAPAK4TYK2JAK3JAK2
SCHEMBL23878775 0.85 AURKA (0.51) AURKATYK2JAK3JAK2JAK1
SCHEMBL23878848 0.85 AURKA (0.56) AURKANTRK1TYK2JAK3JAK2
SCHEMBL23878737 0.84 TYK2 (0.45) AURKAPAK4TYK2JAK3JAK2
SCHEMBL23878966 0.84 TYK2 (0.50) AURKATYK2JAK3JAK2JAK1

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 1417/4885PAK4 542/4885NTRK1 2151/4885

“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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