SCHEMBL30786133

SCHEMBL30786133

CNC(=O)c1ccc(F)cc1S

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.47
CES2 O00748 2/20 0.42
CES1 P23141 2/20 0.42
HPGD P15428 2/20 0.39
ALDH1A1 P00352 2/20 0.39
KDM4E B2RXH2 2/20 0.39
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
IKBKB O14920 1/20 0.38
JAK2 O60674 1/20 0.37
JAK1 P23458 1/20 0.37
TYK2 P29597 1/20 0.37
PDE4D Q08499 1/20 0.37
BRAF P15056 1/20 0.37
HDAC1 Q13547 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
BRD4 O60885 1/20 0.37
PLK1 P53350 2/20 0.37
MAPK3 P27361 2/20 0.37
MAPK1 P28482 2/20 0.37

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
SCHEMBL30786200 0.85 GAA (0.47) GAACES2CES1HPGDALDH1A1
SCHEMBL30786178 0.85 GAA (0.47) GAACES2CES1HPGDALDH1A1
SCHEMBL909599 0.81 CES2 (0.61) GAACES2CES1ALDH1A1KDM4E
SCHEMBL30786210 0.81 L3MBTL1 (0.42) CES2CES1KDM4ENPC1RAB9A
SCHEMBL7980249 0.79 GAA (0.48) GAACES2CES1HPGDALDH1A1
SCHEMBL1774955 0.79 GAA (0.48) GAACES2CES1HPGDALDH1A1
Hydrochloric Acid SCHEMBL29775858 0.79 CES2 (0.59) GAACES2CES1ALDH1A1KDM4E
SCHEMBL27970875 0.79 KDM4E (0.50) GAACES2HPGDALDH1A1KDM4E
SCHEMBL1417617 0.79 KMT2A (0.49) GAACES2HPGDALDH1A1KDM4E
SCHEMBL705662 0.78 HDAC1 (0.48) GAACES2CES1HPGDALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20260049071-A1 PROTEIN TYROSINE KINASE INHIBITOR AND MEDICAL USE THEREOF BEYANG THERAPEUTICS CO LTD (CN) 2026-02-19 US disclosed
EP-4556466-A1 PROTEIN TYROSINE KINASE INHIBITOR AND MEDICAL USE THEREOF Beyang Therapeutics Co., Ltd. (CN) 2025-05-21 EP disclosed
CN-119604488-A Protein tyrosine kinase inhibitor and medical application thereof 苏州必扬医药科技有限公司 2025-03-11 CN disclosed
WO-2024032584-A1 PROTEIN TYROSINE KINASE INHIBITOR AND MEDICAL USE THEREOF 苏州必扬医药科技有限公司 2024-02-15 WO 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-20260049071-A1 PROTEIN TYROSINE KINASE INHIBITOR AND MEDICAL USE THEREOF KDR, FLT1, ERBB2 GAA 2442/4885CES2 3920/4885CES1 1928/4885

“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.