SCHEMBL30495129

SCHEMBL30495129

O=c1cc(-c2ccc(O)cc2)oc2c(I)c(O)c(I)c(O)c12

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 4/20 0.68
▸ PKM P14618 3/20 0.68
▸ MAPT P10636 3/20 0.68
▸ KDM4E B2RXH2 3/20 0.68
▸ APEX1 P27695 2/20 0.68
▸ TDP1 Q9NUW8 2/20 0.68
▸ GAA P10253 2/20 0.68
▸ INPPL1 O15357 1/20 0.68
▸ ALPL P05186 1/20 0.68
▸ POLB P06746 1/20 0.68
▸ ALPI P09923 1/20 0.68
▸ ALPG P10696 1/20 0.68
▸ RECQL P46063 1/20 0.68
▸ BLM P54132 1/20 0.68
▸ MCL1 Q07820 1/20 0.68
▸ PFKFB3 Q16875 1/20 0.68
▸ L3MBTL1 Q9Y468 1/20 0.68
▸ PPARG P37231 1/20 0.58
▸ CDK5 Q00535 2/20 0.57
▸ CDK5R1 Q15078 2/20 0.57

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
SCHEMBL6725127 0.88 GABRP (0.62) KMT2APKMMAPTKDM4EAPEX1
SCHEMBL29974497 0.81 KMT2A (1.00) KMT2APKMMAPTKDM4EAPEX1
SCHEMBL14053704 0.81 KMT2A (1.00) KMT2APKMMAPTKDM4EAPEX1
SCHEMBL24840880 0.79 KMT2A (0.72) KMT2APKMMAPTKDM4EAPEX1
SCHEMBL29615754 0.77 KMT2A (0.68) KMT2APKMMAPTKDM4EAPEX1
SCHEMBL30269735 0.77 KMT2A (0.68) KMT2APKMMAPTKDM4EAPEX1
SCHEMBL28104733 0.77 KMT2A (0.78) KMT2APKMMAPTKDM4EAPEX1
SCHEMBL28986431 0.76 CBS (0.78) KMT2APKMMAPTKDM4EAPEX1
SCHEMBL476215 0.76 CBS (0.78) KMT2APKMMAPTKDM4EAPEX1
SCHEMBL29435853 0.76 CBS (0.78) KMT2APKMMAPTKDM4EAPEX1

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
CN-113563399-B Method for preparing tiacumicin B iodide and other aromatic iodination products and application thereof 中国科学院南海海洋研究所 2023-06-27 — — CN disclosed
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