SCHEMBL5555765

SCHEMBL5555765

COC(=O)c1sc2cncc(Br)c2c1C

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.45
HPGD P15428 5/20 0.45
KDM4E B2RXH2 3/20 0.45
HSD17B10 Q99714 3/20 0.45
HTT P42858 2/20 0.45
GLA P06280 2/20 0.45
GAA P10253 2/20 0.45
CASP1 P29466 1/20 0.45
CASP7 P55210 1/20 0.45
NCOA1 Q15788 1/20 0.45
RCE1 Q9Y256 1/20 0.45
NCOA3 Q9Y6Q9 1/20 0.45
ATM Q13315 3/20 0.42
MAPT P10636 5/20 0.38
KMT2A Q03164 4/20 0.38
MEN1 O00255 3/20 0.38
LMNA P02545 2/20 0.38
MAPK1 P28482 2/20 0.38
PSMD14 O00487 1/20 0.38
GPR35 Q9HC97 1/20 0.38

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
SCHEMBL31509828 1.00 ALDH1A1 (0.45) ALDH1A1HPGDKDM4EHSD17B10HTT
SCHEMBL15516982 0.84 KDM4E (0.57) ALDH1A1HPGDKDM4EHSD17B10HTT
SCHEMBL27192197 0.82 ALDH1A1 (0.51) ALDH1A1HPGDKDM4EHSD17B10HTT
SCHEMBL31509761 0.82 ALDH1A1 (0.51) ALDH1A1HPGDKDM4EHSD17B10HTT
SCHEMBL31059905 0.82 ICAM1 (0.38) ALDH1A1HPGDKDM4EGAALMNA
SCHEMBL5550510 0.79 ALDH1A1 (0.46) ALDH1A1HPGDKDM4EHSD17B10HTT
SCHEMBL3816392 0.78 LMNA (0.48) ALDH1A1HPGDKDM4EHSD17B10GLA
SCHEMBL31059924 0.75 HSD17B10 (0.44) ALDH1A1HPGDKDM4EHSD17B10HTT
SCHEMBL15517761 0.73 KDM4E (0.58) ALDH1A1HPGDKDM4EHSD17B10HTT
SCHEMBL7855369 0.73 ALDH1A1 (0.43) ALDH1A1HPGDKDM4EHSD17B10HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12410183-B2 Sars-cov2 main protease inhibitors GILEAD SCIENCES, INC. (US) 2025-09-09 US disclosed
EP-4565574-A1 SARS-COV2 MAIN PROTEASE INHIBITORS GILEAD SCIENCES, INC. (US) 2025-06-11 EP disclosed
CN-119731159-A SARS-CoV2 main proteinase inhibitor 吉利德科学公司 2025-03-28 CN disclosed
US-20250042915-A1 SARS-COV2 MAIN PROTEASE INHIBITORS GILEAD SCIENCES, INC. 2025-02-06 US disclosed
US-12091420-B2 SARS-COV2 main protease inhibitors GILEAD SCIENCES, INC. (US) 2024-09-17 US disclosed
US-20240239807-A1 SARS-COV2 MAIN PROTEASE INHIBITORS GILEAD SCIENCES, INC. 2024-07-18 US disclosed
US-20240116946-A1 SARS-COV2 MAIN PROTEASE INHIBITORS GILEAD SCIENCES, INC. 2024-04-11 US disclosed
WO-2024031089-A1 SARS-COV2 MAIN PROTEASE INHIBITORS GILEAD SCIENCES, INC. (US) 2024-02-08 WO disclosed
EP-1753428-A2 KINASE INHIBITORS AS THERAPEUTIC AGENTS Abbott Laboratories (US) 2007-02-21 EP disclosed
US-20060074102-A1 Kinase inhibitors as therapeutic agents ABBOTT LABORATORIES 2006-04-06 US disclosed
WO-2005110410-A2 KINASE INHIBITORS AS THERAPEUTIC AGENTS ABBOTT LABORATORIES (US) 2005-11-24 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 (6 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-20250042915-A1 SARS-COV2 MAIN PROTEASE INHIBITORS ACE2, TMPRSS2, ACE ALDH1A1 3259/4885HPGD 2198/4885KDM4E 3744/4885
US-12091420-B2 SARS-COV2 main protease inhibitors ACE2, TMPRSS2, ACE ALDH1A1 3259/4885HPGD 2198/4885KDM4E 3744/4885
US-20240116946-A1 SARS-COV2 MAIN PROTEASE INHIBITORS ACE2, TMPRSS2, ACE ALDH1A1 3259/4885HPGD 2198/4885KDM4E 3744/4885
US-20060074102-A1 Kinase inhibitors as therapeutic agents ABL1, MAP3K19, MAP3K20 ALDH1A1 2415/4885HPGD 3775/4885KDM4E 965/4885
US-12410183-B2 Sars-cov2 main protease inhibitors ACE2, TMPRSS2, ACE ALDH1A1 3259/4885HPGD 2198/4885KDM4E 3744/4885
US-20240239807-A1 SARS-COV2 MAIN PROTEASE INHIBITORS ACE2, TMPRSS2, ACE ALDH1A1 3259/4885HPGD 2198/4885KDM4E 3744/4885

“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.