SCHEMBL10484334

SCHEMBL10484334

O=P(O)(O)C(CCCCCCSc1ccc(Cl)cc1)P(=O)(O)O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC3 O15379 2/20 0.52
HDAC4 P56524 2/20 0.52
HDAC1 Q13547 2/20 0.52
HDAC7 Q8WUI4 2/20 0.52
HDAC2 Q92769 2/20 0.52
HDAC10 Q969S8 2/20 0.52
HDAC11 Q96DB2 2/20 0.52
HDAC8 Q9BY41 2/20 0.52
HDAC6 Q9UBN7 2/20 0.52
HDAC9 Q9UKV0 2/20 0.52
HDAC5 Q9UQL6 2/20 0.52
MMP2 P08253 1/20 0.47
MMP8 P22894 1/20 0.47
MMP14 P50281 1/20 0.47
FDPS P14324 5/20 0.47
KDM4E B2RXH2 5/20 0.46
ALDH1A1 P00352 2/20 0.46
PKM P14618 1/20 0.46
LMNA P02545 1/20 0.42
TEAD1 P28347 1/20 0.42

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
SCHEMBL10483987 0.84 FDPS (0.40) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL2598121 0.83 FDPS (0.42) MMP2FDPSALDH1A1LMNA
SCHEMBL10484141 0.81 MTNR1A (0.47) MMP2MMP8FDPSKDM4EALDH1A1
SCHEMBL10484023 0.80 MAPT (0.45) MMP2MMP8MMP14FDPSKDM4E
SCHEMBL10484084 0.77 FDPS (0.51) MMP2MMP8MMP14FDPSMMP1
SCHEMBL9808024 0.77 KDM4E (0.59) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL7866245 0.77 KDM4E (0.50) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL2455508 0.77 ALDH1A1 (0.53) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL8955502 0.74 HDAC3 (0.58) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL26116458 0.74 HDAC3 (0.58) HDAC3HDAC4HDAC1HDAC7HDAC2

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
US-4876248-A Anti-inflammatory products derived from methylene-diphosphonic acid, and process for their preparation SANOFI (FR) 1989-10-24 US disclosed
US-4746654-A ANTIARTHRITIC SANOFI (FR) 1988-05-24 US disclosed