SCHEMBL27192091

SCHEMBL27192091

Cc1cc(Cl)c(B(O)O)cc1Cl

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CD44 P16070 1/20 0.42
CYP3A4 P08684 2/20 0.39
LMNA P02545 1/20 0.39
GRIN2D O15399 1/20 0.35
GRIN3B O60391 1/20 0.35
GRIN1 Q05586 1/20 0.35
GRIN2A Q12879 1/20 0.35
GRIN2B Q13224 1/20 0.35
GRIN2C Q14957 1/20 0.35
GRIN3A Q8TCU5 1/20 0.35
SIRT1 Q96EB6 1/20 0.35
CHRM1 P11229 1/20 0.33
ALOX15 P16050 1/20 0.33
MAOA P21397 1/20 0.33
TBXA2R P21731 1/20 0.33
ADRA1A P35348 1/20 0.33
HTR2B P41595 1/20 0.33
GAA P10253 2/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
MAPT P10636 1/20 0.32

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
SCHEMBL15279773 0.90 CD44 (0.42) CD44CYP3A4LMNAGRIN2DGRIN3B
SCHEMBL31332518 0.87 TTR (0.36) CYP3A4ALOX15SMN1; SMN2ALDH1A1TTR
SCHEMBL20956940 0.85 CD44 (0.42) CD44CYP3A4LMNAGRIN2DGRIN3B
SCHEMBL15757193 0.82 SIRT1 (0.36) CD44CYP3A4LMNASIRT1CHRM1
SCHEMBL29951092 0.81 HSD17B10 (0.41) CYP3A4LMNASIRT1CHRM1ALOX15
SCHEMBL7816171 0.81 HSD17B10 (0.41) CYP3A4LMNASIRT1CHRM1ALOX15
SCHEMBL13299606 0.79 CD44 (0.38) CD44CYP3A4LMNAGRIN2DGRIN3B
SCHEMBL30241530 0.79 CYP3A4 (0.35) CD44CYP3A4SIRT1CHRM1ALOX15
SCHEMBL15757566 0.79 CYP3A4 (0.35) CD44CYP3A4SIRT1CHRM1ALOX15
SCHEMBL25129194 0.78 HSD17B10 (0.36) CYP3A4LMNASIRT1CHRM1ALOX15

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 6 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
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
US-20220340893-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2022-10-27 US 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 (5 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 CD44 4314/4885CYP3A4 195/4885LMNA 3885/4885
US-12091420-B2 SARS-COV2 main protease inhibitors ACE2, TMPRSS2, ACE CD44 4314/4885CYP3A4 195/4885LMNA 3885/4885
US-20240116946-A1 SARS-COV2 MAIN PROTEASE INHIBITORS ACE2, TMPRSS2, ACE CD44 4314/4885CYP3A4 195/4885LMNA 3885/4885
US-12410183-B2 Sars-cov2 main protease inhibitors ACE2, TMPRSS2, ACE CD44 4314/4885CYP3A4 195/4885LMNA 3885/4885
US-20240239807-A1 SARS-COV2 MAIN PROTEASE INHIBITORS ACE2, TMPRSS2, ACE CD44 4314/4885CYP3A4 195/4885LMNA 3885/4885

“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.