SCHEMBL25547276

SCHEMBL25547276

Cc1ccc(S(=O)(=O)OCC[C@H]2CC23CCN(C(=O)OC(C)(C)C)CC3)cc1

nearest known ligand 0.68

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 12/20 0.68
NAMPT P43490 6/20 0.46
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
MMP13 P45452 1/20 0.43

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
SCHEMBL30451018 1.00 GPR119 (0.68) GPR119NAMPTMEN1KMT2AMMP13
SCHEMBL22284240 0.94 GPR119 (0.70) GPR119NAMPTMEN1KMT2A
SCHEMBL282240 0.83 GPR119 (0.60) GPR119MEN1KMT2AMMP13
SCHEMBL31511500 0.82 GPR119 (0.53) GPR119MEN1KMT2AMMP13
SCHEMBL4980907 0.81 MEN1 (0.48) GPR119MEN1KMT2AMMP13
SCHEMBL4973467 0.81 MEN1 (0.48) GPR119MEN1KMT2AMMP13
SCHEMBL29770088 0.81 HTR7 (0.52) GPR119MEN1KMT2A
SCHEMBL28537628 0.81 GPR119 (0.46) GPR119MEN1KMT2AMMP13
SCHEMBL28537559 0.81 GPR119 (0.46) GPR119MEN1KMT2AMMP13
SCHEMBL28537557 0.81 GPR119 (0.46) GPR119MEN1KMT2AMMP13

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11655216-B2 Aryl and heteroaryl ether derivatives as liver X receptor beta agonists, compositions, and their use MERCK SHARP & DOHME LLC (US) 2023-05-23 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 (1 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-11655216-B2 Aryl and heteroaryl ether derivatives as liver X receptor beta agonists, compositions, and their use NR1H2, NR1H3, NR1H4 GPR119 15/4885NAMPT 4040/4885MEN1 4463/4885

“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.