SCHEMBL25045543

SCHEMBL25045543

CS(=O)(=O)c1ncc(C#CCCCC(=O)NCc2cn(I)nn2)cn1

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ PARP14 Q460N5 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
SCHEMBL22561348 0.80 ALDH1A1 (0.32) —
SCHEMBL22618750 0.79 FAAH (0.36) —
SCHEMBL22551273 0.77 CYP1A2 (0.32) —
SCHEMBL23193195 0.77 OPRM1 (0.34) —
SCHEMBL21137867 0.77 CYP1A2 (0.34) —
SCHEMBL27409838 0.76 FOLH1 (0.31) —
SCHEMBL22618800 0.74 GBA1 (0.38) —
SCHEMBL29263596 0.74 ALDH1A1 (0.35) —
SCHEMBL25045545 0.74 FFAR1 (0.32) —
SCHEMBL30674488 0.74 ALDH1A1 (0.32) —

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
WO-2023016488-A1 MICROTUBULE INHIBITOR-BASED ANTIBODY-DRUG CONJUGATE 昆山新蕴达生物科技有限公司 2023-02-16 — — WO disclosed
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