SCHEMBL27046701

SCHEMBL27046701

NC(=O)N1C(=O)[C@H](Cc2ccncc2)C1C(=O)O

nearest known ligand 0.44

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ ELANE P08246 6/20 0.44
▸ F11 P03951 5/20 0.43
▸ TPSAB1 Q15661 7/20 0.41
▸ TPSD1 Q9BZJ3 7/20 0.41
▸ TPSG1 Q9NRR2 7/20 0.41
▸ FOLH1 Q04609 1/20 0.37

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
SCHEMBL27046584 0.76 TPSAB1 (0.45) F11TPSAB1TPSD1TPSG1FOLH1
SCHEMBL20302623 0.73 ELANE (0.38) ELANEF11TPSAB1TPSD1TPSG1
SCHEMBL18476312 0.72 F11 (0.76) ELANEF11TPSAB1TPSD1TPSG1
SCHEMBL21478292 0.72 ELANE (0.38) ELANEF11TPSAB1TPSD1TPSG1
SCHEMBL20302389 0.72 F11 (0.57) F11
SCHEMBL16997586 0.70 F11 (0.57) ELANEF11TPSAB1TPSD1TPSG1
SCHEMBL16997636 0.69 F11 (0.68) F11TPSAB1TPSD1TPSG1
SCHEMBL27046465 0.67 TPSAB1 (0.33) F11TPSAB1TPSD1TPSG1
SCHEMBL4751699 0.67 F11 (0.62) F11TPSAB1TPSD1TPSG1
SCHEMBL16998455 0.66 TPSAB1 (0.45) TPSAB1TPSD1TPSG1

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
EP-4309653-A1 THERAPEUTIC COMPOUNDS AND COMPOSITIONS Exithera Pharmaceuticals Inc. (US) 2024-01-24 — — EP disclosed
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