SCHEMBL22570525

SCHEMBL22570525

COc1ccccc1Cc1ccc(C2=CCC(F)(F)CC2)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LTA4H P09960 1/20 0.44
▸ SLC5A1 P13866 6/20 0.38
▸ SLC5A2 P31639 6/20 0.38
▸ CHEK2 O96017 1/20 0.36
▸ HTR2C P28335 1/20 0.36
▸ CHRM2 P08172 1/20 0.36
▸ CHRM1 P11229 1/20 0.36
▸ HRH1 P35367 1/20 0.36
▸ USP2 O75604 1/20 0.36
▸ CYP2D6 P10635 1/20 0.36
▸ BCHE P06276 1/20 0.35
▸ ACHE P22303 1/20 0.35
▸ LMNA P02545 2/20 0.35
▸ TSHR P16473 2/20 0.35
▸ MAPK1 P28482 1/20 0.35
▸ TDP1 Q9NUW8 1/20 0.35
▸ HTR1A P08908 1/20 0.35
▸ ADRA1D P25100 1/20 0.35
▸ ADRA1A P35348 1/20 0.35
▸ ADRA1B P35368 1/20 0.35

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
SCHEMBL22448159 0.84 LTA4H (0.40) LTA4HSLC5A1SLC5A2CHEK2HTR2C
SCHEMBL22448133 0.83 HSD11B1 (0.33) SLC5A1SLC5A2
SCHEMBL22448157 0.82 TRPV3 (0.34) SLC5A1SLC5A2HTR2C
SCHEMBL22448141 0.81 TAAR1 (0.33) HTR2CL3MBTL1IDO1
SCHEMBL22448131 0.73 SLC5A1 (0.53) SLC5A1SLC5A2
SCHEMBL27462498 0.73 LTA4H (0.58) LTA4HCHRM2CHRM1HRH1HTR1A
SCHEMBL3153666 0.71 KMT2A (0.56) LTA4HSLC5A1SLC5A2CHRM2CHRM1
SCHEMBL30407818 0.71 SIGMAR1 (0.39) HTR2CKDM4EL3MBTL1
SCHEMBL621779 0.69 HTR1A (0.58) LTA4HCHRM2CHRM1HRH1LMNA
SCHEMBL1682187 0.68 LTA4H (0.52) LTA4HSLC5A1SLC5A2CHRM2CHRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10822365-B1 SGLTS inhibitor and application thereof SHANDONG DANHONG PHARMACEUTICAL CO., LTD. (CN) 2020-11-03 — — US disclosed
US-20200331950-A1 SGLTS INHIBITOR AND APPLICATION THEREOF SHANDONG DANHONG PHARMACEUTICAL CO., LTD. 2020-10-22 — — 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 (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-10822365-B1 SGLTS inhibitor and application thereof SLC5A1, SLC5A2, SLC5A11 LTA4H 3318/4885SLC5A1 1/4885SLC5A2 2/4885
US-20200331950-A1 SGLTS INHIBITOR AND APPLICATION THEREOF SLC5A1, SLC5A2, SLC5A11 LTA4H 3318/4885SLC5A1 1/4885SLC5A2 2/4885

“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.

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