Ledazerol

Ledazerol

SCHEMBL8989308

OCc1cccc(Cc2c[nH]cn2)c1O

nearest known ligand 0.38

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Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 2/20 0.33
GABRB2 P47870 2/20 0.33
KDM4E B2RXH2 1/20 0.33
LMNA P02545 1/20 0.33
TP53 P04637 1/20 0.33
MAPT P10636 1/20 0.33
TSHR P16473 1/20 0.33
ALOX12 P18054 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
SCHEMBL8098434 0.79 ALDH1A1 (0.34) KDM4ETSHR
SCHEMBL9518487 0.79 HMGB1 (0.48) KDM4ELMNATSHR
SCHEMBL9518244 0.78 SHBG (0.40) KDM4ELMNA
Mivazerol SCHEMBL593708 0.78 PARP1 (0.39) KDM4EMAPTTSHR
SCHEMBL8089240 0.78 HMGB1 (0.31)
Mivazerol SCHEMBL8097939 0.78 PARP1 (0.39) KDM4EMAPTTSHR
Hydrochloric Acid SCHEMBL10401999 0.78 HMGB1 (0.47) KDM4ELMNATSHR
SCHEMBL9645443 0.77 MPO (0.38) KDM4ELMNA
SCHEMBL9647526 0.77 PLK1 (0.38) KDM4ELMNA
Mivazerol SCHEMBL8865135 0.77 PARP1 (0.38) KDM4EMAPTTSHR

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-0269599-B1 Substituted 1H-imidazoles UCB SA (BE) 1993-12-15 EP claimed
US-4814343-A ANTIISCHEMIC U C B, S.A. (BE) 1989-03-21 US claimed
EP-0269599-A2 Substituted 1H-imidazoles U C B, S.A. (BE) 1988-06-01 EP claimed
EP-0719139-A1 USE OF CENTRALLY ACTIVE ALPHAAGONISTS FOR INHIBING POSTRAUMATIC METABOLIC STRESS Dr. Karl Thomae GmbH (DE) 1996-07-03 EP disclosed
WO-1995003798-A2 USE OF CENTRALLY EFFECTIVE α-2 AGONISTS FOR INHIBITING POSTAGGRESSION METABOLISM BOEHRINGER INGELHEIM INT (DE) 1995-02-09 WO disclosed
EP-0269599-B1 Substituted 1H-imidazoles UCB SA (BE) 1993-12-15 EP disclosed
EP-0341231-B1 SUBSTITUTED 1-(1H-IMIDAZOL-4-YL)ALKYL BENZAMIDES U C B, S.A. (BE) 1992-11-19 EP disclosed
US-4923865-A Substituted 1-(1H-imidazol-4-yl)alkyl-benzamides as anti-ischemics and as alpha-2-adrenergic receptor agonists U C B SOCIETE ANONYME (BE) 1990-05-08 US disclosed
US-4814343-A ANTIISCHEMIC U C B, S.A. (BE) 1989-03-21 US disclosed
EP-0269599-A2 Substituted 1H-imidazoles U C B, S.A. (BE) 1988-06-01 EP disclosed