SCHEMBL30112798

SCHEMBL30112798

O=C(NCCOCCOCCCCCCCl)c1ccc2c(c1)C1(OC2=O)c2ccc(N3CC(C(=O)N4CCOCC4)C3)cc2Oc2cc(N3CC(C(=O)N4CCOCC4)C3)ccc21

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ NT5E P21589 2/20 0.39
▸ RORC P51449 1/20 0.34
▸ FOLH1 Q04609 1/20 0.33
▸ NAALAD2 Q9Y3Q0 1/20 0.33
▸ HPGD P15428 1/20 0.32
▸ MMP14 P50281 1/20 0.32
▸ NOTUM Q6P988 1/20 0.32
▸ TTR P02766 1/20 0.32
▸ ALDH1A1 P00352 3/20 0.32
▸ HTT P42858 1/20 0.32
▸ OPRM1 P35372 1/20 0.31
▸ PRKDC P78527 1/20 0.31
▸ HPGDS O60760 1/20 0.31
▸ F10 P00742 2/20 0.31
▸ RET P07949 1/20 0.31
▸ KDR P35968 1/20 0.31
▸ TSHR P16473 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
SCHEMBL24942966 1.00 NT5E (0.39) NT5ERORCFOLH1NAALAD2HPGD
SCHEMBL30112803 1.00 NT5E (0.39) NT5ERORCFOLH1NAALAD2HPGD
SCHEMBL30112567 0.91 NT5E (0.40) NT5ERORCFOLH1NAALAD2MMP14
SCHEMBL24942508 0.91 NT5E (0.40) NT5ERORCFOLH1NAALAD2MMP14
SCHEMBL30112650 0.89 NT5E (0.39) NT5ERORCFOLH1NAALAD2HPGD
SCHEMBL24942980 0.89 NT5E (0.39) NT5ERORCFOLH1NAALAD2HPGD
SCHEMBL24942978 0.88 NT5E (0.39) NT5ERORCFOLH1NAALAD2HPGD
SCHEMBL30112627 0.88 NT5E (0.39) NT5ERORCFOLH1NAALAD2HPGD
SCHEMBL18526322 0.88 NT5E (0.41) NT5ERORCMMP14TTRALDH1A1
SCHEMBL29250145 0.87 NOTUM (0.32) NOTUMALDH1A1HTTOPRM1PRKDC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4655355-A1 PHOTOACTIVE FLUORESCENT COMPOUNDS AND USE THEREOF FOR LABELING OF PROTEINS Eikon Therapeutics, Inc. (US) 2025-12-03 — — EP disclosed
WO-2024159100-A1 PHOTOACTIVE FLUORESCENT COMPOUNDS AND USE THEREOF FOR LABELING OF PROTEINS EIKON THERAPEUTICS, INC. (US) 2024-08-02 — — WO disclosed
EP-4377311-A1 2-DIAZO-3-OXO-2,3-DIHYDROSPIRO[INDENE-1,9'-XANTHENE] DERIVATIVES AND SIMILAR COMPOUNDS AS PHOTOACTIVE FLUORESCENT COMPOUNDS FOR PROTEIN LABELING Eikon Therapeutics Inc. (US) 2024-06-05 — — EP disclosed
WO-2023009503-A1 2-DIAZO-3-OXO-2,3-DIHYDROSPIRO[INDENE-1,9'-XANTHENE] DERIVATIVES AND SIMILAR COMPOUNDS AS PHOTOACTIVE FLUORESCENT COMPOUNDS FOR PROTEIN LABELING EIKON THERAPEUTICS INC. (US) 2023-02-02 — — WO disclosed
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