SCHEMBL24259317

SCHEMBL24259317

CC(C)(C)c1noc(CCCCCNc2cncc(Br)c2)n1

nearest known ligand 0.34

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 5/20 0.34
CNR1 P21554 4/20 0.34
SIRT2 Q8IXJ6 1/20 0.32
SLC22A12 Q96S37 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
SCHEMBL22352723 0.84 DRD4 (0.38) CNR2CNR1SIRT2
SCHEMBL22354116 0.80 HDAC4 (0.30) SLC22A12
SCHEMBL24259059 0.79 NR1H4 (0.36) CNR2CNR1
SCHEMBL22353002 0.79 ABL1 (0.38) CNR2CNR1SIRT2
SCHEMBL24259027 0.79 L3MBTL1 (0.33) CNR2CNR1SIRT2
SCHEMBL24259543 0.76 CNR2 (0.40) CNR2CNR1SIRT2
SCHEMBL22352807 0.70 NR1H4 (0.41) CNR2CNR1
SCHEMBL22352983 0.69 CNR2 (0.35) CNR2CNR1
SCHEMBL1419851 0.68 CHRNB2 (0.43) SLC22A12
SCHEMBL22347375 0.68 NR1H4 (0.40)

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 CNR2 631/4885CNR1 325/4885SIRT2 2746/4885
US-11254663-B2 Substituted bicyclic compounds as farnesoid X receptor modulators FXR1, NR1H4, FXR2 CNR2 631/4885CNR1 325/4885SIRT2 2746/4885
US-11713312-B2 Substituted bicyclic compounds as farnesoid X receptor modulators FXR1, NR1H4, FXR2 CNR2 631/4885CNR1 325/4885SIRT2 2746/4885

“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.