SCHEMBL30950621

SCHEMBL30950621

O=C(CNc1cccc(C(=O)O)c1)Nc1ccccc1Sc1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 7/20 0.55
▸ KMT2A Q03164 5/20 0.55
▸ MEN1 O00255 3/20 0.55
▸ BLM P54132 2/20 0.55
▸ TDP1 Q9NUW8 4/20 0.55
▸ AKR1C3 P42330 1/20 0.54
▸ MAPT P10636 1/20 0.54
▸ L3MBTL1 Q9Y468 6/20 0.54
▸ LMNA P02545 4/20 0.54
▸ HPGD P15428 1/20 0.54
▸ ATM Q13315 1/20 0.54
▸ NPSR1 Q6W5P4 2/20 0.49
▸ MAPK1 P28482 2/20 0.49
▸ HTT P42858 2/20 0.49
▸ CYP1A2 P05177 1/20 0.49
▸ CYP3A4 P08684 1/20 0.49
▸ CYP2D6 P10635 1/20 0.49
▸ CYP2C9 P11712 1/20 0.49
▸ CYP2C19 P33261 1/20 0.49
▸ POLB P06746 1/20 0.46

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
SCHEMBL30950637 0.89 TDP1 (0.57) ALDH1A1KMT2AMEN1BLMTDP1
SCHEMBL30950620 0.87 ALDH1A1 (0.56) ALDH1A1KMT2AMEN1BLMTDP1
SCHEMBL30950627 0.83 L3MBTL1 (0.53) ALDH1A1KMT2AMEN1BLMTDP1
SCHEMBL30950632 0.83 TDP1 (0.50) ALDH1A1KMT2AMEN1BLMTDP1
SCHEMBL30950628 0.83 TDP1 (0.50) ALDH1A1KMT2AMEN1BLMTDP1
SCHEMBL30950623 0.83 L3MBTL1 (0.51) ALDH1A1KMT2AMEN1BLMTDP1
SCHEMBL30950636 0.83 KMT2A (0.53) ALDH1A1KMT2AMEN1BLMTDP1
SCHEMBL30950631 0.82 L3MBTL1 (0.50) ALDH1A1KMT2AMEN1BLMTDP1
SCHEMBL26264767 0.77 TDP1 (0.71) ALDH1A1KMT2AMEN1BLMTDP1
SCHEMBL30950619 0.77 ALDH1A1 (0.47) ALDH1A1KMT2AMEN1BLMTDP1

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-4635488-A1 PHARMACEUTICAL COMPOSITION FOR PREVENTING OR TREATING BONE DISEASES Industry Foundation of Chonnam National University (KR) 2025-10-22 — — EP disclosed
WO-2024128335-A1 PHARMACEUTICAL COMPOSITION FOR PREVENTING OR TREATING BONE DISEASES 전남대학교산학협력단 2024-06-20 — — WO disclosed
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