Medronic Acid

Medronic Acid

SCHEMBL402438

C1CCCNCC1.N.O=P(O)(O)CP(=O)(O)O.O=P(O)(O)CP(=O)(O)O.O=P(O)(O)CP(=O)(O)O.O=P(O)(O)CP(=O)(O)O

nearest known ligand 0.50

Full drug profile on Sugi Atlas →

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.50
MMP2 P08253 1/20 0.50
THRB P10828 1/20 0.50
MAPK1 P28482 1/20 0.50
HSD17B10 Q99714 1/20 0.50
ALDH1A1 P00352 1/20 0.45
FDPS P14324 3/20 0.34
OTC P00480 1/20 0.33
CXCR4 P61073 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
ANPEP P15144 1/20 0.32
ERAP2 Q6P179 1/20 0.32
MAPT P10636 1/20 0.30

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
Medronic Acid SCHEMBL9222563 0.89 KDM4E (0.62) KDM4EMMP2THRBMAPK1HSD17B10
Medronic Acid SCHEMBL9469376 0.87 KDM4E (0.67) KDM4EMMP2THRBMAPK1HSD17B10
Medronic Acid SCHEMBL9485739 0.84 KDM4E (0.62) KDM4EMMP2THRBMAPK1HSD17B10
Medronic Acid SCHEMBL9810806 0.84 KDM4E (0.62) KDM4EMMP2THRBMAPK1HSD17B10
Medronic Acid SCHEMBL10954777 0.84 KDM4E (0.62) KDM4EMMP2THRBMAPK1HSD17B10
Medronic Acid SCHEMBL9485093 0.84 KDM4E (0.62) KDM4EMMP2THRBMAPK1HSD17B10
Piperidine SCHEMBL5874248 0.81 ALDH1A1 (0.60) MMP2ALDH1A1FDPSCXCR4SMN1; SMN2
Piperidine SCHEMBL9857707 0.81 ALDH1A1 (0.60) MMP2ALDH1A1FDPSCXCR4SMN1; SMN2
Piperidine SCHEMBL5874242 0.81 ALDH1A1 (0.60) MMP2ALDH1A1FDPSCXCR4SMN1; SMN2
Piperidine SCHEMBL1242732 0.81 ALDH1A1 (0.60) MMP2ALDH1A1FDPSCXCR4SMN1; SMN2

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-8101554-B2 Well treatment comprising a polymer formed from a diallyl ammonium salt and a scale inhibitor CHAMPION TECHNOLOGIES LTD. (GB) 2012-01-24 US disclosed
WO-2011021043-A1 WELL TREATMENT STATOIL ASA (NO) 2011-02-24 WO disclosed