SCHEMBL9313832

SCHEMBL9313832

Cc1cc(N(C)CP(=O)(O)O)ccc1F

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP13 P45452 1/20 0.34
PGK1 P00558 2/20 0.33
PGK2 P07205 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
MAOA P21397 1/20 0.33
MAOB P27338 1/20 0.33
MEN1 O00255 1/20 0.33
NPC1 O15118 1/20 0.33
LMNA P02545 1/20 0.33
POLB P06746 1/20 0.33
MAPT P10636 1/20 0.33
MAPK1 P28482 1/20 0.33
MMP14 P50281 1/20 0.33
RAB9A P51151 1/20 0.33
KMT2A Q03164 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
GRIN2B Q13224 3/20 0.33
GRIN1 Q05586 2/20 0.33
KCNH2 Q12809 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
SCHEMBL9313751 0.78 CA12 (0.39) MAPTMAPK1RAB9AKMT2A
SCHEMBL9315794 0.74 ALDH1A1 (0.43) SMN1; SMN2MEN1NPC1LMNAPOLB
SCHEMBL9314821 0.73 ACP3 (0.42) MEN1NPC1RAB9AKMT2ATDP1
SCHEMBL13414024 0.73 POLB (0.37) MMP13SMN1; SMN2MAOAMAOBMEN1
SCHEMBL9314612 0.72 HTR3E (0.46) SMN1; SMN2MEN1NPC1LMNAMAPT
SCHEMBL15935766 0.70 MAPT (0.47) NPC1MAPTMAPK1RAB9AKMT2A
SCHEMBL21900976 0.70 MAOA (0.35) SMN1; SMN2MAOAMAOBMEN1NPC1
SCHEMBL8801336 0.70 MEN1 (0.50) MEN1KMT2A
Hydrochloric Acid SCHEMBL8800744 0.68 MEN1 (0.48) MEN1KMT2A
SCHEMBL10780791 0.67 MAPT (0.61) MMP13SMN1; SMN2MEN1NPC1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5315035-A Hydrogen peroxide detection BOEHRINGER MANNHEIM GMBH (DE) 1994-05-24 US claimed
US-5315035-A Hydrogen peroxide detection BOEHRINGER MANNHEIM GMBH (DE) 1994-05-24 US disclosed
US-5084382-A A color former with an oxidizable coupler for detection of hydrogen peroxide or hydrogen peroxide forming system or peroxidase or oxidizers for amine detection BOEHRINGER MANNHEIM GMBH (DE) 1992-01-28 US disclosed
EP-0175250-B1 AGENT AND PROCESS FOR THE DETERMINATION OF REDOX SYSTEMS Roche Diagnostics GmbH (DE) 1990-05-09 EP disclosed
US-4820632-A ANILINE DERIVATIVE AND OXIDIZABLE COUPLER COLORED COMPOUND FOR DETECTION OF HYDROGEN PEROXIDE; MEDICAL DIAGNOSIS BOEHRINGER MANNHEIM GMBH (DE) 1989-04-11 US disclosed
EP-0175250-A2 Agent and process for the determination of redox systems Roche Diagnostics GmbH (DE) 1986-03-26 EP disclosed