SCHEMBL26769372

SCHEMBL26769372

CC(C)c1cccc(OP(Cl)Oc2cccc(C(C)C)c2)c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 3/20 0.45
▸ TSHR P16473 1/20 0.45
▸ HDAC4 P56524 2/20 0.41
▸ HDAC8 Q9BY41 2/20 0.41
▸ ALDH1A1 P00352 2/20 0.39
▸ SMN1; SMN2 Q16637 2/20 0.39
▸ LMNA P02545 1/20 0.39
▸ MDM4 O15151 1/20 0.39
▸ CA1 P00915 1/20 0.39
▸ CA2 P00918 1/20 0.39
▸ TP53 P04637 1/20 0.39
▸ CYP3A4 P08684 1/20 0.39
▸ MAPT P10636 1/20 0.39
▸ TYR P14679 1/20 0.39
▸ HPGD P15428 1/20 0.39
▸ ALOX15 P16050 1/20 0.39
▸ ALOX12 P18054 1/20 0.39
▸ CA5A P35218 1/20 0.39
▸ HTT P42858 1/20 0.39
▸ MDM2 Q00987 1/20 0.39

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
SCHEMBL2863259 0.84 KDM4E (0.47) KDM4ETSHRHDAC4HDAC8ALDH1A1
SCHEMBL31604177 0.81 KDM4E (0.45) KDM4ETSHRHDAC4HDAC8ALDH1A1
SCHEMBL11063307 0.77 PTGS1 (0.56) KDM4ETSHRHDAC4HDAC8ALDH1A1
SCHEMBL30345552 0.77 PTGS1 (0.56) KDM4ETSHRHDAC4HDAC8ALDH1A1
SCHEMBL11703421 0.77 KDM4E (0.42) KDM4ETSHRHDAC4HDAC8ALDH1A1
SCHEMBL84440 0.75 HDAC4 (0.55) KDM4ETSHRHDAC4HDAC8ALDH1A1
SCHEMBL30601580 0.75 HDAC4 (0.55) KDM4ETSHRHDAC4HDAC8ALDH1A1
SCHEMBL15849013 0.75 PTGS1 (0.55) KDM4ETSHRHDAC4HDAC8ALDH1A1
SCHEMBL14252175 0.74 KDM4E (0.46) KDM4ETSHRHDAC4HDAC8ALDH1A1
SCHEMBL6559447 0.74 ACHE (0.50) ALDH1A1SMN1; SMN2LMNACA1CA2

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-4289855-A1 METHOD FOR PREPARING PHOSPHORUS-CONTAINING LIGAND Zhejiang NHU Company Ltd. (CN) 2023-12-13 — — EP disclosed
WO-2023206791-A1 METHOD FOR PREPARING PHOSPHORUS-CONTAINING LIGAND 浙江新和成股份有限公司 2023-11-02 — — WO disclosed
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