SCHEMBL9398468

SCHEMBL9398468

O=C(O)c1cc(O)c2ccc(I)cc2n1

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ IGFBP5 P24593 6/20 0.43
▸ IGFBP3 P17936 2/20 0.43
▸ ALOX15 P16050 2/20 0.40
▸ TSHR P16473 1/20 0.37
▸ HIF1A Q16665 1/20 0.37
▸ APP P05067 2/20 0.37
▸ KDM4E B2RXH2 1/20 0.36
▸ MAPT P10636 1/20 0.36
▸ RAB9A P51151 1/20 0.36
▸ TDP1 Q9NUW8 1/20 0.36
▸ IGFBP1 P08833 1/20 0.36
▸ IGFBP2 P18065 1/20 0.36
▸ IGFBP4 P22692 1/20 0.36
▸ IGFBP6 P24592 1/20 0.36
▸ MGAM O43451 1/20 0.36

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
SCHEMBL4471851 0.88 IGFBP5 (0.41) IGFBP5IGFBP3ALOX15TSHRHIF1A
SCHEMBL9398497 0.85 NQO2 (0.47) APP
SCHEMBL2905794 0.83 IGFBP5 (0.46) IGFBP5IGFBP3ALOX15TSHRHIF1A
SCHEMBL2902980 0.81 ALOX15 (0.47) IGFBP5IGFBP3ALOX15TSHRHIF1A
7-Chlorokynurenic Acid SCHEMBL29386783 0.80 IGFBP3 (0.47) IGFBP5IGFBP3HIF1A
SCHEMBL2909734 0.80 MCL1 (0.44) IGFBP5IGFBP3ALOX15KDM4E
7-Chlorokynurenic Acid SCHEMBL157187 0.80 IGFBP3 (0.47) IGFBP5IGFBP3HIF1A
7-Chlorokynurenic Acid SCHEMBL31238955 0.80 IGFBP3 (0.47) IGFBP5IGFBP3HIF1A
SCHEMBL2909106 0.80 IGFBP5 (0.45) IGFBP5IGFBP3ALOX15KDM4E
SCHEMBL2905327 0.80 GRM2 (0.49) IGFBP5IGFBP3ALOX15KDM4EMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5344922-A 4-hydroxyquinaldic acid derivatives BOARD OF REGENTS, UNIVERSITY OF TEXAS 1994-09-06 — — US disclosed
US-5028707-A 4-hydroxyquinaldic acid derivatives BOARD OF REGENTS, UNIVERSITY OF TEXAS (US) 1991-07-02 — — US disclosed
WO-1991007390-A1 4-HYDROXYQUINALDIC ACID DERIVATIVES BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 1991-05-30 — — WO disclosed
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