SCHEMBL3700524

SCHEMBL3700524

CP(=O)(OC(=O)Nc1cc2ccccc2cc1COC(=O)Nc1ccccc1)Oc1cccc2ccccc12

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.43
KMT2A Q03164 4/20 0.43
ALDH1A1 P00352 3/20 0.43
LMNA P02545 3/20 0.43
HPGD P15428 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
KDM4E B2RXH2 1/20 0.43
POLB P06746 3/20 0.39
DAPK1 P53355 1/20 0.39
PIM3 Q86V86 1/20 0.39
MITF O75030 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
PLAU P00749 1/20 0.37
G6PD P11413 1/20 0.37
MGLL Q99685 1/20 0.36
NPSR1 Q6W5P4 2/20 0.36
MAPT P10636 1/20 0.36

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
SCHEMBL10316830 0.80 HTR1D (0.42) MEN1KMT2AALDH1A1KDM4EPOLB
SCHEMBL10316812 0.78 HTR1D (0.40) MEN1KMT2AALDH1A1KDM4EPOLB
SCHEMBL10317008 0.78 BCHE (0.41) MEN1KMT2AALDH1A1HPGDKDM4E
SCHEMBL10317160 0.76 CD274 (0.39) MEN1KMT2AALDH1A1HPGDPOLB
SCHEMBL3700522 0.74 CMA1 (0.58) MEN1KMT2AALDH1A1LMNAHPGD
SCHEMBL10317183 0.74 MEN1 (0.36) MEN1KMT2AALDH1A1HPGDPOLB
SCHEMBL436837 0.74 DRD4 (0.44) MEN1KMT2AALDH1A1LMNAHPGD
SCHEMBL1083649 0.69 CMA1 (0.56) MEN1KMT2ALMNAHPGDSMN1; SMN2
SCHEMBL1048549 0.68 CMA1 (0.69) POLBPLAU
SCHEMBL3704000 0.68 MAPT (0.44) ALDH1A1HPGDSMN1; SMN2KDM4EMAPT

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-2211867-A1 PROCESS FOR SYNTHESIZING PHOSPHONIC AND PHOSPHINIC ACID COMPOUNDS Janssen Pharmaceutica N.V. (BE) 2010-08-04 EP disclosed
WO-2009051746-A1 PROCESS FOR SYNTHESIZING PHOSPHONIC AND PHOSPHINIC ACID COMPOUNDS JANSSEN PHARMACEUTICA, N.V. (BE) 2009-04-23 WO disclosed