SCHEMBL31756758

SCHEMBL31756758

COCCOCCOCCOCCOCCOCCOCCOCCNC(=O)C(CCC(N)=O)NC(=O)CCCC#Cc1cnc(S(C)(=O)=O)nc1

nearest known ligand 0.35

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ GLP1R P43220 8/20 0.35
▸ NMT2 O60551 1/20 0.35
▸ NMT1 P30419 1/20 0.35
▸ MEN1 O00255 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ PIK3CD O00329 1/20 0.31
▸ PIK3CA P42336 1/20 0.31
▸ PIK3CG P48736 1/20 0.31
▸ ITGB1 P05556 1/20 0.31
▸ ITGA4 P13612 1/20 0.31
▸ SMN1; SMN2 Q16637 1/20 0.31
▸ LTB4R Q15722 1/20 0.30
▸ CHRNA1 P02708 1/20 0.30
▸ CHRNG P07510 1/20 0.30
▸ CHRNB1 P11230 1/20 0.30
▸ CHRND Q07001 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
SCHEMBL31697519 0.81 TLR2 (0.33) NMT2NMT1
SCHEMBL31538110 0.80 CA2 (0.35) GLP1RMEN1KMT2ASMN1; SMN2
SCHEMBL25701620 0.79 CA2 (0.34) SMN1; SMN2
SCHEMBL31697409 0.77 EPHX2 (0.36) MEN1KMT2ASMN1; SMN2
SCHEMBL25696350 0.77 EPHX2 (0.36) MEN1KMT2ASMN1; SMN2
SCHEMBL25046488 0.76 CCKAR (0.38) CHRNA1CHRNGCHRNB1CHRND
SCHEMBL22618814 0.74 FFAR1 (0.32) ITGB1ITGA4
SCHEMBL31575300 0.74 NMT2 (0.36) NMT2NMT1ITGB1ITGA4
SCHEMBL23193205 0.73 GLP1R (0.32) GLP1R
SCHEMBL31217941 0.73 TLR2 (0.36) PIK3CDPIK3CAPIK3CGSMN1; SMN2

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-20260001891-A1 FUSED RING COMPOUND, CONJUGATE THEREOF AND USE THEREOF KEYMED BIOSCIENCES (CHENGDU) CO., LTD. (CN) 2026-01-01 — — 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-20260001891-A1 FUSED RING COMPOUND, CONJUGATE THEREOF AND USE THEREOF HCCS, H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, CBR1 GLP1R 2431/4885NMT2 227/4885NMT1 130/4885

“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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