SCHEMBL23619931

SCHEMBL23619931

CN(C)/C=N/S(=O)(=O)c1cc(NC(=O)OC(C)(C)C)cc2c(Cl)nccc12

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ATR Q13535 1/20 0.41
CYP17A1 P05093 2/20 0.35
CA12 O43570 1/20 0.34
CA1 P00915 1/20 0.34
CA9 Q16790 1/20 0.34
MAP4K4 O95819 1/20 0.34
SREBF2 Q12772 1/20 0.33
EGLN2 Q96KS0 1/20 0.33
ALDH1A1 P00352 1/20 0.33
RORC P51449 2/20 0.33
MAPKAPK2 P49137 3/20 0.33
MAPK14 Q16539 1/20 0.32
NAMPT P43490 1/20 0.32
EGFR P00533 1/20 0.31
AURKB Q96GD4 1/20 0.31
MEN1 O00255 1/20 0.31
THRB P10828 1/20 0.31
KMT2A Q03164 1/20 0.31
LMNA P02545 1/20 0.31

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
SCHEMBL23619734 0.82 NAMPT (0.39) CYP17A1ALDH1A1NAMPT
SCHEMBL24714003 0.82 ATR (0.42) ATRCYP17A1CA12CA1CA9
SCHEMBL23619996 0.82 MAPKAPK2 (0.35) ATRMAP4K4EGLN2ALDH1A1RORC
SCHEMBL23619711 0.79 KCNJ5 (0.48) ALDH1A1THRBLMNA
SCHEMBL23619974 0.78 ANO1 (0.37) ALDH1A1MEN1THRBKMT2ALMNA
SCHEMBL23619859 0.76 SMN1; SMN2 (0.47) KMT2ALMNA
SCHEMBL24686353 0.76 KCNJ6 (0.44) CA12CA1CA9ALDH1A1MEN1
SCHEMBL23619981 0.76 LMNA (0.37) ALDH1A1LMNA
SCHEMBL23619858 0.76 LMNA (0.37) LMNA
SCHEMBL23620037 0.75 ACLY (0.45) ATRCYP17A1ALDH1A1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230118751-A1 FUSED RING COMPOUND AND APPLICATION THEREOF WUHAN LL SCIENCE AND TECHNOLOGY DEVELOPMENT CO., LTD. (CN) 2023-04-20 US disclosed
EP-4079724-A1 FUSED RING COMPOUND AND APPLICATION THEREOF Wuhan LL Science and Technology Development Co., Ltd. (CN) 2022-10-26 EP disclosed
WO-2021136238-A1 FUSED RING COMPOUND AND APPLICATION THEREOF 武汉朗来科技发展有限公司 2021-07-08 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-20230118751-A1 FUSED RING COMPOUND AND APPLICATION THEREOF P2RX4, P2RX3, P2RX2 ATR 3975/4885CYP17A1 1034/4885CA12 2471/4885

“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.