SCHEMBL31098806

SCHEMBL31098806

NS(=O)(=O)c1nnc(NC(=O)CCCCCCCNC(=O)OCC2c3ccccc3-c3ccccc32)s1

nearest known ligand 0.58

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 1/20 0.58
▸ CA2 P00918 18/20 0.53
▸ CA1 P00915 17/20 0.53
▸ CA4 P22748 14/20 0.53
▸ CA9 Q16790 13/20 0.53
▸ CA12 O43570 12/20 0.53
▸ CA14 Q9ULX7 12/20 0.53
▸ CA5A P35218 11/20 0.53
▸ CA7 P43166 11/20 0.53
▸ CA5B Q9Y2D0 11/20 0.53
▸ CA3 P07451 10/20 0.53
▸ CA6 P23280 10/20 0.53
▸ CA13 Q8N1Q1 10/20 0.53

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
SCHEMBL19382918 1.00 KMT2A (0.58) KMT2ACA2CA1CA4CA9
SCHEMBL19382591 0.98 KMT2A (0.56) KMT2ACA2CA1CA4CA9
SCHEMBL14315055 0.81 CA2 (0.53) KMT2ACA2CA1CA4CA9
SCHEMBL5550978 0.78 KMT2A (0.76) KMT2A
SCHEMBL14639568 0.77 KMT2A (0.81) KMT2ACA2CA1
SCHEMBL14086099 0.77 KMT2A (0.81) KMT2ACA2CA1
SCHEMBL793384 0.77 KMT2A (0.85) KMT2A
SCHEMBL14073776 0.76 KMT2A (0.76) KMT2A
SCHEMBL19359120 0.76 CA2 (0.77) CA2CA1CA4CA9CA12
SCHEMBL8046428 0.75 KMT2A (0.91) KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4676538-A2 BI-SPECIFIC ADAPTERS AND THEIR USE WITH UNIVERSAL CAR-T CELLS IN THE TREATMENT OF CAIX-EXPRESSING TUMORS Purdue Research Foundation (US) 2026-01-14 — — EP disclosed
WO-2024191887-A2 BI-SPECIFIC ADAPTERS AND THEIR USE WITH UNIVERSAL CAR-T CELLS IN THE TREATMENT OF CAIX-EXPRESSING TUMORS PURDUE RESEARCH FOUNDATION (US) 2024-09-19 — — WO disclosed
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