SCHEMBL6575438

SCHEMBL6575438

O=[N+]([O-])c1ccc2c(c1)OP(=O)(O)O2

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.42
TSHR P16473 4/20 0.42
GPR35 Q9HC97 2/20 0.42
TP53 P04637 1/20 0.42
HPGD P15428 1/20 0.42
MAPK1 P28482 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
MEN1 O00255 3/20 0.41
MAPT P10636 3/20 0.41
KMT2A Q03164 3/20 0.41
HTT P42858 1/20 0.41
LMNA P02545 1/20 0.41
GAA P10253 1/20 0.41
THRB P10828 1/20 0.41
CA12 O43570 1/20 0.41
CA1 P00915 1/20 0.41
CA9 Q16790 1/20 0.41
TDP1 Q9NUW8 3/20 0.40
HSD17B10 Q99714 1/20 0.40
CRYZ Q08257 1/20 0.39

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
SCHEMBL7064131 1.00 ALDH1A1 (0.42) ALDH1A1TSHRGPR35TP53HPGD
SCHEMBL2390951 0.72 ALDH1A1 (0.52) ALDH1A1TSHRGPR35TP53HPGD
SCHEMBL5798781 0.72 MEN1 (0.59) ALDH1A1TSHRSMN1; SMN2MEN1MAPT
SCHEMBL22058720 0.69 CA1 (0.46) ALDH1A1TSHRGPR35TP53HPGD
SCHEMBL10920807 0.69 HSD17B10 (0.46) ALDH1A1TSHRGPR35TP53HPGD
SCHEMBL27539091 0.69 GPR84 (0.57) MAPK1SMN1; SMN2MEN1KMT2A
SCHEMBL5804639 0.69 GPR84 (0.57) MAPK1SMN1; SMN2MEN1KMT2A
SCHEMBL141303 0.68 MAPT (0.59) ALDH1A1SMN1; SMN2MEN1MAPTKMT2A
SCHEMBL1169369 0.68 MAPT (0.60) ALDH1A1HPGDMAPK1SMN1; SMN2MEN1
SCHEMBL30665998 0.68 MAPT (0.60) ALDH1A1HPGDMAPK1SMN1; SMN2MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6830884-B1 Method of amplification MOLECULAR STAGING INC. 2004-12-14 US disclosed
WO-2002064816-A9 MULTIPLE DETERMINANTS FOR METABOLIC PHENOTYPES UNIV MCGILL (CA) 2004-03-18 WO disclosed
EP-1373551-A2 MULTIPLE DETERMINANTS FOR METABOLIC PHENOTYPES McGill University (CA) 2004-01-02 EP disclosed
US-20030091975-A1 Multiple determinants for metabolic phenotypes MCGILL UNIVERSITY (CA) 2003-05-15 US disclosed
EP-1141417-A4 A METHOD OF AMPLIFICATION OF A CIRCULARISED NUCLEIC ACID PROBE DIATECH PTY LTD (AU) 2003-04-09 EP disclosed
US-20030039964-A1 Method DIATECH PTY LTD (AU) 2003-02-27 US disclosed
WO-2002064816-A2 MULTIPLE DETERMINANTS FOR METABOLIC PHENOTYPES MCGILL UNIVERSITY (CA) 2002-08-22 WO disclosed
WO-2001085988-A1 METHODS FOR DETECTING NUCLEIC ACID MOLECULES HAVING PARTICULAR NUCLEOTIDE SEQUENCES DIATECH PTY. LTD. (AU) 2001-11-15 WO disclosed
EP-1141417-A1 A METHOD OF AMPLIFICATION OF A CIRCULARISED NUCLEIC ACID PROBE Diatech Pty. Ltd. (AU) 2001-10-10 EP disclosed
WO-2000036141-A1 A METHOD OF AMPLIFICATION OF A CIRCULARISED NUCLEIC ACID PROBE DIATECH PTY. LTD. (AU) 2000-06-22 WO disclosed