SCHEMBL497

SCHEMBL497

Cc1ccc(-c2ccccc2C=C[N+](=O)[O-])cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FBP1 P09467 5/20 0.54
RXRA P19793 1/20 0.49
TLR4 O00206 2/20 0.45
TLR2 O60603 2/20 0.45
HPRT1 P00492 1/20 0.45
PRMT1 Q99873 1/20 0.44
MAPT P10636 7/20 0.43
NPSR1 Q6W5P4 7/20 0.43
ALDH1A1 P00352 6/20 0.43
HPGD P15428 5/20 0.43
LMNA P02545 4/20 0.43
SMN1; SMN2 Q16637 3/20 0.43
RAB9A P51151 2/20 0.43
S1PR4 O95977 2/20 0.43
S1PR1 P21453 2/20 0.43
MAPK1 P28482 2/20 0.43
TLR9 Q9NR96 2/20 0.43
NPC1 O15118 1/20 0.43
ITGA4 P13612 1/20 0.43
CCR6 P51684 2/20 0.40

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
SCHEMBL496 1.00 FBP1 (0.54) FBP1RXRATLR4TLR2HPRT1
SCHEMBL27673733 0.86 FBP1 (0.55) FBP1RXRATLR4TLR2PRMT1
SCHEMBL1722178 0.84 FBP1 (0.54) FBP1RXRATLR4TLR2PRMT1
SCHEMBL10535971 0.81 FBP1 (0.50) FBP1RXRATLR4TLR2HPRT1
SCHEMBL10535968 0.81 FBP1 (0.50) FBP1RXRATLR4TLR2HPRT1
SCHEMBL7313258 0.80 RXRA (0.51) FBP1RXRATLR4TLR2PRMT1
SCHEMBL27947395 0.78 RXRA (0.54) FBP1RXRATLR4TLR2PRMT1
SCHEMBL798355 0.75 RXRA (0.58) FBP1RXRATLR4TLR2PRMT1
SCHEMBL798354 0.75 RXRA (0.58) FBP1RXRATLR4TLR2PRMT1
SCHEMBL7935139 0.75 CDK4 (0.47) HPRT1MAPTNPSR1ALDH1A1HPGD

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
EP-0733366-B1 Pharmaceutical compositions comprising angiotensin II receptor blocking imidazoles and diuretics DU PONT (US) 1998-04-01 EP disclosed
EP-0324377-B1 Angiotensin II receptor blocking imidazoles and combinations thereof with diuretics and NSaids DU PONT (US) 1997-04-16 EP disclosed
EP-0733366-A2 Pharmaceutical compositions comprising angiotensin II receptor blocking imidazoles and diuretics E.I. DU PONT DE NEMOURS AND COMPANY (US) 1996-09-25 EP disclosed
EP-0253310-B1 Angiotensin II receptor blocking imidazoles DU PONT (US) 1994-10-26 EP disclosed
US-5155118-A Administering angiotensin inhibitor E. I. DU PONT DE NEMOURS AND COMPANY (US) 1992-10-13 US disclosed
US-5153197-A Treatment of hypertension with angiotensin II blocking imidazoles E. I. DU PONT DE NEMOURS AND COMPANY (US) 1992-10-06 US disclosed
US-5138069-A Treating hypertension and congestive heart failure E. I. DU PONT DE NEMOURS AND COMPANY (US) 1992-08-11 US disclosed
US-5128355-A Hypotensive E. I. DU PONT DE NEMOURS AND COMPANY (US) 1992-07-07 US disclosed
EP-0324377-A2 Angiotensin II receptor blocking imidazoles and combinations thereof with diuretics and NSaids E.I. DU PONT DE NEMOURS AND COMPANY (US) 1989-07-19 EP disclosed
WO-1989006233-A1 ANGIOTENSIN II RECEPTOR BLOCKING IMIDAZOLES AND COMBINATIONS THEREOF WITH DIURETICS AND NSAIDS E.I. DU PONT DE NEMOURS AND COMPANY (US) 1989-07-13 WO disclosed