SCHEMBL31057737

SCHEMBL31057737

COCCOc1ccc(-c2nc(CC(=O)NCC(=O)O)cs2)cc1NC(=O)CO

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ SHMT2 P34897 5/20 0.52
▸ SHMT1 P34896 4/20 0.52
▸ ALDH1A1 P00352 5/20 0.48
▸ KDM4E B2RXH2 4/20 0.48
▸ HPGD P15428 4/20 0.48
▸ GAA P10253 2/20 0.48
▸ MAPT P10636 2/20 0.42
▸ EGLN1 Q9GZT9 1/20 0.42
▸ LMNA P02545 3/20 0.39
▸ TSHR P16473 1/20 0.39
▸ HSD17B10 Q99714 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ HTT P42858 1/20 0.38

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
SCHEMBL31057952 0.92 SHMT2 (0.52) SHMT2SHMT1ALDH1A1KDM4EHPGD
SCHEMBL31057885 0.87 SHMT2 (0.47) SHMT2SHMT1ALDH1A1KDM4EHPGD
SCHEMBL31057931 0.87 SHMT2 (0.47) SHMT2SHMT1ALDH1A1KDM4EHPGD
SCHEMBL31057941 0.87 SHMT2 (0.47) SHMT2SHMT1ALDH1A1KDM4EHPGD
SCHEMBL31057926 0.84 SHMT2 (0.45) SHMT2SHMT1ALDH1A1KDM4EHPGD
SCHEMBL31057813 0.81 MAPT (0.42) SHMT2SHMT1ALDH1A1KDM4EHPGD
SCHEMBL20255896 0.79 KDM4E (0.76) SHMT2SHMT1ALDH1A1KDM4EHPGD
SCHEMBL31057890 0.78 SHMT2 (0.56) SHMT2SHMT1ALDH1A1KDM4EHPGD
SCHEMBL31057781 0.77 SHMT2 (0.62) SHMT2SHMT1ALDH1A1KDM4EHPGD
SCHEMBL31058015 0.77 SHMT2 (0.57) SHMT2SHMT1ALDH1A1KDM4EHPGD

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-2024173718-A2 HETEROBIFUNCTIONAL BINDERS OF KLHDC2 ST. JUDE CHILDREN'S RESEARCH HOSPITAL (US) 2024-08-22 — — WO disclosed
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