SCHEMBL25643125

SCHEMBL25643125

COC(=O)c1ccc(OC[C@@]2(C(C)OC)CCCc3cc(Cl)ccc32)c(Cl)n1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SLC6A15 Q9H2J7 1/20 0.38
▸ MRGPRX4 Q96LA9 5/20 0.38
▸ TPH1 P17752 1/20 0.37
▸ CNR2 P34972 1/20 0.35
▸ KDM4C Q9H3R0 1/20 0.35
▸ IDH1 O75874 1/20 0.33
▸ S1PR4 O95977 1/20 0.33
▸ PPARG P37231 1/20 0.33
▸ PPARD Q03181 1/20 0.33
▸ PPARA Q07869 1/20 0.33
▸ HDAC3 O15379 1/20 0.32
▸ HDAC1 Q13547 1/20 0.32
▸ HDAC2 Q92769 1/20 0.32
▸ HDAC6 Q9UBN7 1/20 0.32
▸ PTGDR Q13258 2/20 0.32
▸ PTGDR2 Q9Y5Y4 2/20 0.32
▸ SMN1; SMN2 Q16637 1/20 0.32
▸ KDM1A O60341 1/20 0.31
▸ MEN1 O00255 1/20 0.31
▸ KMT2A Q03164 1/20 0.31

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
SCHEMBL23386596 0.92 SLC6A15 (0.39) SLC6A15MRGPRX4TPH1CNR2KDM4C
SCHEMBL23386591 0.83 SLC6A15 (0.40) SLC6A15MRGPRX4TPH1CNR2KDM4C
SCHEMBL25643128 0.79 S1PR4 (0.36) S1PR4KDM1A
SCHEMBL26314795 0.77 KDM1A (0.38) KDM4CPPARGPPARDPPARASMN1; SMN2
SCHEMBL26194442 0.75 LMNA (0.39) S1PR4SMN1; SMN2MEN1KMT2A
SCHEMBL26314917 0.75 HCAR3 (0.39) SMN1; SMN2MEN1KMT2A
SCHEMBL23442629 0.74 USP2 (0.38) MRGPRX4KDM4CHDAC3HDAC1HDAC2
SCHEMBL20523241 0.74 SLC6A15 (0.41) SLC6A15MRGPRX4TPH1KDM4CS1PR4
SCHEMBL20523238 0.74 SLC6A15 (0.41) SLC6A15MRGPRX4TPH1KDM4CS1PR4
SCHEMBL17565610 0.74 KDM1A (0.43) KDM4CKDM1A

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-11667652-B2 MCL1 inhibitors GILEAD SCIENCES, INC. (US) 2023-06-06 — — 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-11667652-B2 MCL1 inhibitors MCL1, BCL2L1, BCLAF1 SLC6A15 4775/4885MRGPRX4 3632/4885TPH1 3606/4885

“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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