SCHEMBL23334281

SCHEMBL23334281

O=C(O)c1scc2c1CCC(F)(F)C2

nearest known ligand 0.36

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.36
HPGD P15428 1/20 0.36
FABP4 P15090 12/20 0.35
FABP5 Q01469 11/20 0.35
XDH P47989 1/20 0.34
KDM4E B2RXH2 1/20 0.31
NPC1 O15118 1/20 0.31
LMNA P02545 1/20 0.31
MAPT P10636 1/20 0.31
NFKB1 P19838 1/20 0.31
RAB9A P51151 1/20 0.31
NFKB2 Q00653 1/20 0.31
RELA Q04206 1/20 0.31
SMN1; SMN2 Q16637 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
SCHEMBL23335659 0.86 TP53 (0.35) TP53HPGDFABP4FABP5KDM4E
SCHEMBL1856215 0.82 TP53 (0.36) TP53HPGDFABP4FABP5KDM4E
SCHEMBL1854014 0.82 S1PR1 (0.37) TP53HPGDFABP4FABP5KDM4E
SCHEMBL1857150 0.79 TP53 (0.38) TP53HPGDKDM4ENPC1LMNA
SCHEMBL22678755 0.79 FABP4 (0.41) HPGDFABP4FABP5KDM4ENPC1
SCHEMBL1860995 0.77 TP53 (0.33) TP53HPGDKDM4ENPC1LMNA
SCHEMBL23335301 0.73 FABP4 (0.31) FABP4FABP5
SCHEMBL23334742 0.72 CES1 (0.38) TP53HPGDFABP4FABP5KDM4E
SCHEMBL3979426 0.72 HPGD (0.62) TP53HPGDKDM4ENPC1LMNA
SCHEMBL23334741 0.72 TP53 (0.57) TP53HPGDKDM4ENPC1LMNA

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
US-20240239763-A1 CRYSTAL FORM OF THIOPHENE DERIVATIVE AND PREPARATION METHOD THEREFOR TONGHUA DONGBAO PHARMACEUTICAL CO., LTD. (CN) 2024-07-18 US disclosed
US-20240239763-A1 CRYSTAL FORM OF THIOPHENE DERIVATIVE AND PREPARATION METHOD THEREFOR TONGHUA DONGBAO PHARMACEUTICAL CO., LTD. (CN) 2024-07-18 US disclosed
US-20230322703-A1 THIOPHENE DERIVATIVES AS XANTHINE OXIDASE INHIBITORS AND APPLICATION THEREOF Dongbao Purple Star (Hangzhou) Biopharmaceutical Co., Ltd. (CN) 2023-10-12 US disclosed
WO-2021083319-A1 THIOPHENE DERIVATIVES AS XANTHINE OXIDASE INHIBITORS AND APPLICATION THEREOF 南京明德新药研发有限公司 2021-05-06 WO disclosed
WO-2021083182-A1 URICOSURIC AGENT, SYNTHETIC METHOD THEREFOR, AND PHARMACEUTICAL APPLICATION THEREOF 南京明德新药研发有限公司 2021-05-06 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 (2 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-20240239763-A1 CRYSTAL FORM OF THIOPHENE DERIVATIVE AND PREPARATION METHOD THEREFOR CYP4F11, WEE1, WEE2 TP53 2203/4885HPGD 2481/4885FABP4 2416/4885
US-20230322703-A1 THIOPHENE DERIVATIVES AS XANTHINE OXIDASE INHIBITORS AND APPLICATION THEREOF XDH, PNPO, TH TP53 4754/4885HPGD 186/4885FABP4 3634/4885

“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.