SCHEMBL10656822

SCHEMBL10656822

CO/C=C(\C(=O)OC)c1ccccc1CP(=O)(O)O

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 1/20 0.40
▸ HPGD P15428 3/20 0.40
▸ ACP3 P15309 1/20 0.39
▸ MMP2 P08253 2/20 0.37
▸ MMP9 P14780 2/20 0.37
▸ MMP12 P39900 2/20 0.37
▸ ALDH1A1 P00352 2/20 0.36
▸ KDM4E B2RXH2 1/20 0.36
▸ RCE1 Q9Y256 1/20 0.36
▸ ATM Q13315 1/20 0.36
▸ LMNA P02545 1/20 0.35

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
SCHEMBL10656827 1.00 TSHR (0.40) TSHRHPGDACP3MMP2MMP9
SCHEMBL9177149 0.89 HPGD (0.40) TSHRHPGDALDH1A1KDM4ERCE1
SCHEMBL7138518 0.89 HPGD (0.40) TSHRHPGDALDH1A1KDM4ERCE1
SCHEMBL7138507 0.89 HPGD (0.40) TSHRHPGDALDH1A1KDM4ERCE1
SCHEMBL9944266 0.84 HPGD (0.41) TSHRHPGDALDH1A1KDM4ERCE1
SCHEMBL10537236 0.84 TSHR (0.39) TSHRHPGDALDH1A1KDM4ERCE1
SCHEMBL7658957 0.82 HPGD (0.46) HPGDALDH1A1KDM4ERCE1LMNA
SCHEMBL7658965 0.82 HPGD (0.46) HPGDALDH1A1KDM4ERCE1LMNA
SCHEMBL7658954 0.82 HPGD (0.46) HPGDALDH1A1KDM4ERCE1LMNA
SCHEMBL20822602 0.81 HPGD (0.39) HPGDALDH1A1KDM4ERCE1ATM

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
US-4782177-A AGRICULTURE BASF AKTIENGESELLSCHAFT (DE) 1988-11-01 — — US disclosed
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