SCHEMBL8648798

SCHEMBL8648798

O=C(O)C(CC1CCCN1)C(C(=O)O)P(=O)(O)O

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FDPS P14324 2/20 0.55
MEN1 O00255 3/20 0.39
KMT2A Q03164 3/20 0.39
LMNA P02545 2/20 0.39
TP53 P04637 2/20 0.39
ALOX15 P16050 2/20 0.39
MITF O75030 1/20 0.39
CYP3A4 P08684 1/20 0.39
MAPT P10636 1/20 0.39
HTT P42858 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
NLRP1 Q9C000 1/20 0.39
GPR55 Q9Y2T6 1/20 0.39
CYP2D6 P10635 2/20 0.37
ALDH1A1 P00352 2/20 0.37
CYP1A2 P05177 2/20 0.37
TSHR P16473 1/20 0.37
MLNR O43193 1/20 0.37
ABCB11 O95342 1/20 0.37

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
SCHEMBL8649503 0.87 FDPS (0.48) FDPSMEN1KMT2ALMNATP53
SCHEMBL8843664 0.85 FDPS (0.47) FDPSMEN1KMT2ALMNATP53
SCHEMBL8646454 0.83 FDPS (0.44) FDPSMEN1KMT2ALMNATP53
SCHEMBL8843563 0.80 FDPS (0.42) FDPSMEN1KMT2ALMNATP53
SCHEMBL8842640 0.76 METAP1 (0.41) FDPSGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL8842783 0.74 METAP1 (0.40) FDPSGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL8646908 0.74 SLC6A1 (0.45) FDPSMEN1KMT2AALOX15ALDH1A1
SCHEMBL8701346 0.71 FDPS (1.00) FDPSMEN1KMT2ALMNATP53
SCHEMBL8645684 0.71 FDPS (0.39) FDPSMEN1KMT2AALOX15ALDH1A1
SCHEMBL8842578 0.71 GRIN2D (0.33) FDPSGRIN2DGRIN3BGRIN1GRIN2A

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0703919-B1 PHOSPHOSUCCINIC ACID DERIVATIVES AND THEIR USE AS MEDICAMENTS BOEHRINGER MANNHEIM GMBH (DE) 1998-09-02 EP claimed
US-5627170-A Phosphonic acid compound containing heterocyclic substituents, pharmaceutical composition contains same and a method of treating calcium metabolism disturbance BOEHRINGER MANNHEIM GMBH (DE) 1997-05-06 US disclosed
US-5538957-A OSTEOPOROSIS BOEHRINGER MANNHEIM GMBH (DE) 1996-07-23 US disclosed