SCHEMBL8938035

SCHEMBL8938035

CCOP(=O)(OCC)C(Cc1ccc(Cl)cc1)(Cc1ccc(Cl)cc1)c1cccc2ccccc12

nearest known ligand 0.67

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ACP3 P15309 2/20 0.67
HPGD P15428 3/20 0.42
KDM4E B2RXH2 2/20 0.42
LMNA P02545 1/20 0.42
ALDH1A1 P00352 3/20 0.38
THRB P10828 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
KMT2A Q03164 3/20 0.36
MEN1 O00255 2/20 0.36
MAPT P10636 2/20 0.36
HTT P42858 2/20 0.36
PTGS2 P35354 5/20 0.36
HSP90AA1 P07900 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
NR1I2 O75469 1/20 0.34
NPBWR1 P48145 1/20 0.34
MCHR1 Q99705 1/20 0.34
SLC6A2 P23975 1/20 0.33
SLC6A4 P31645 1/20 0.33

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
SCHEMBL8938007 0.81 ACP3 (1.00) ACP3HPGDKDM4EALDH1A1KMT2A
SCHEMBL8938015 0.79 ACP3 (0.53) ACP3HPGDKDM4ELMNAALDH1A1
Butane SCHEMBL8938014 0.71 ACP3 (0.54) ACP3HPGDKDM4EALDH1A1KMT2A
SCHEMBL8832067 0.67 HPGD (0.46) ACP3HPGDKDM4ELMNAALDH1A1
SCHEMBL8938043 0.66 ACP3 (0.54) ACP3HPGDKDM4ELMNAALDH1A1
SCHEMBL3346090 0.66 ACP3 (0.61) ACP3HPGDKDM4ELMNAL3MBTL1
SCHEMBL5580152 0.64 DRD4 (0.49) ACP3HPGDALDH1A1THRBL3MBTL1
SCHEMBL10631805 0.63 KDM4E (0.54) HPGDKDM4ELMNAALDH1A1HTT
SCHEMBL28223073 0.63 KDM4E (0.54) HPGDKDM4ELMNAALDH1A1HTT
SCHEMBL518217 0.62 POLB (0.44) HPGDKDM4ELMNAALDH1A1L3MBTL1

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-5508273-A ARALKYLPHOSPHONATES FOR OSTEOPOROSIS ORTHO PHARMACEUTICAL CORPORATION (US) 1996-04-16 US disclosed