SCHEMBL23878951

SCHEMBL23878951

Cc1cc(Nc2nc(NC3CC4CCC(C3)N4C(=O)CN(C)C)nc3ccsc23)n[nH]1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TYK2 P29597 12/20 0.57
▸ JAK3 P52333 12/20 0.57
▸ JAK2 O60674 11/20 0.57
▸ JAK1 P23458 10/20 0.57
▸ PAK1 Q13153 3/20 0.49
▸ DYRK3 O43781 1/20 0.42
▸ PRKD3 O94806 1/20 0.42
▸ MAP4K4 O95819 1/20 0.42
▸ PAK4 O96013 1/20 0.42
▸ ABL1 P00519 1/20 0.42
▸ LCK P06239 1/20 0.42
▸ FYN P06241 1/20 0.42
▸ CSF1R P07333 1/20 0.42
▸ RET P07949 1/20 0.42
▸ IGF1R P08069 1/20 0.42
▸ MET P08581 1/20 0.42
▸ ROS1 P08922 1/20 0.42
▸ FGFR1 P11362 1/20 0.42
▸ PRKACA P17612 1/20 0.42
▸ FLT1 P17948 1/20 0.42

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
SCHEMBL30147239 1.00 TYK2 (0.57) TYK2JAK3JAK2JAK1PAK1
SCHEMBL22054602 1.00 TYK2 (0.57) TYK2JAK3JAK2JAK1PAK1
SCHEMBL22055116 1.00 TYK2 (0.57) TYK2JAK3JAK2JAK1PAK1
SCHEMBL30255579 0.89 PAK1 (0.53) TYK2JAK3JAK2JAK1PAK1
SCHEMBL30255381 0.89 PAK1 (0.53) TYK2JAK3JAK2JAK1PAK1
SCHEMBL24996444 0.88 JAK3 (0.55) TYK2JAK3JAK2JAK1PAK4
SCHEMBL22055383 0.88 JAK2 (0.57) TYK2JAK3JAK2JAK1PAK4
SCHEMBL23879060 0.88 JAK2 (0.57) TYK2JAK3JAK2JAK1PAK4
SCHEMBL23878772 0.87 TYK2 (0.49) TYK2JAK3JAK2JAK1PAK1
SCHEMBL22053998 0.87 TYK2 (0.49) TYK2JAK3JAK2JAK1PAK1

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115925705-A Heteroaromatic derivative regulator, preparation method and application thereof 江苏豪森药业集团有限公司 2023-04-07 — — CN disclosed
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
CN-115667228-A Salt and crystal form of heteroaromatic derivative and preparation method of salt and crystal form 上海翰森生物医药科技有限公司 2023-01-31 — — CN disclosed
CN-111511738-B Heteroaromatic derivative regulator, preparation method and application thereof 江苏豪森药业集团有限公司 2023-01-20 — — CN 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 TYK2 105/4885JAK3 88/4885JAK2 19/4885

“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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