SCHEMBL24258924

SCHEMBL24258924

OCCCCCc1ccnc(Cl)n1

nearest known ligand 0.35

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 2/20 0.35
KDM4E B2RXH2 1/20 0.34
NUDT1 P36639 1/20 0.33
HRH1 P35367 1/20 0.33
FFAR1 O14842 1/20 0.32
TLR7 Q9NYK1 1/20 0.32
RECQL P46063 1/20 0.32
SORD Q00796 1/20 0.31
NAAA Q02083 1/20 0.31
KCNH3 Q9ULD8 1/20 0.31
CA2 P00918 1/20 0.31
SIRT2 Q8IXJ6 1/20 0.30
TBXAS1 P24557 1/20 0.30

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
SCHEMBL2018150 0.85 RECQL (0.35) KCNH2FFAR1RECQLSORD
SCHEMBL3003171 0.82 KCNH2 (0.56) KCNH2KDM4ETBXAS1
SCHEMBL4301655 0.80 KCNH2 (0.53) KCNH2
SCHEMBL24799116 0.80 NOS2 (0.38) KCNH2HRH1FFAR1
SCHEMBL16178953 0.78 KCNH2 (0.46) KCNH2TLR7
SCHEMBL15577831 0.77
SCHEMBL24258919 0.76 KCNH2 (0.32) KCNH2FFAR1
SCHEMBL27667823 0.74 KCNH2 (0.42) KCNH2KDM4ETLR7
SCHEMBL24258741 0.73 HPGD (0.44) CA2
SCHEMBL4263566 0.73 HRH1 (0.45) HRH1FFAR1

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-11713312-B2 Substituted bicyclic compounds as farnesoid X receptor modulators BRISTOL-MYERS SQUIBB COMPANY (US) 2023-08-01 US disclosed
US-20220135550-A1 SUBSTITUTED BICYCLIC COMPOUNDS AS FARNESOID X RECEPTOR MODULATORS BRISTOL MYERS SQUIBB CO (US) 2022-05-05 US disclosed
US-11254663-B2 Substituted bicyclic compounds as farnesoid X receptor modulators BRISTOL-MYERS SQUIBB COMPANY (US) 2022-02-22 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 (3 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-20220135550-A1 SUBSTITUTED BICYCLIC COMPOUNDS AS FARNESOID X RECEPTOR MODULATORS FXR1, NR1H4, FXR2 KCNH2 4885/4885KDM4E 3793/4885NUDT1 1817/4885
US-11254663-B2 Substituted bicyclic compounds as farnesoid X receptor modulators FXR1, NR1H4, FXR2 KCNH2 4885/4885KDM4E 3793/4885NUDT1 1817/4885
US-11713312-B2 Substituted bicyclic compounds as farnesoid X receptor modulators FXR1, NR1H4, FXR2 KCNH2 4885/4885KDM4E 3793/4885NUDT1 1817/4885

“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.