SCHEMBL7749583

SCHEMBL7749583

C=CCc1ccc2ccc3cccc4c(O)cc1c2c34

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 2/20 0.41
GABRB2 P47870 2/20 0.41
AKR1B1 P15121 1/20 0.39
SRD5A1 P18405 1/20 0.38
MTNR1A P48039 1/20 0.38
ALDH1A1 P00352 5/20 0.37
HSD17B10 Q99714 4/20 0.37
CYP1A2 P05177 1/20 0.37
THRB P10828 1/20 0.37
HPGD P15428 1/20 0.37
POLB P06746 1/20 0.36
GAA P10253 2/20 0.36
LMNA P02545 2/20 0.36
KMT2A Q03164 2/20 0.36
MAPT P10636 1/20 0.36
ALOX12 P18054 1/20 0.36
AURKA O14965 1/20 0.36
DAPK3 O43293 1/20 0.36
MAP4K4 O95819 1/20 0.36
RET P07949 1/20 0.36

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
SCHEMBL28804419 0.81 HSD17B10 (0.44) GABRA1GABRB2MTNR1AALDH1A1HSD17B10
SCHEMBL728402 0.80 KMT2A (0.47) GABRA1GABRB2MTNR1AALDH1A1HSD17B10
SCHEMBL8724008 0.78 ALDH1A1 (0.43) GABRA1GABRB2MTNR1AALDH1A1HSD17B10
SCHEMBL10337992 0.78 ALDH1A1 (0.40) GABRA1GABRB2ALDH1A1HPGDGAA
SCHEMBL729571 0.77 ALDH1A1 (0.47) GABRA1GABRB2MTNR1AALDH1A1HSD17B10
SCHEMBL12827498 0.76 GABRA1 (0.42) GABRA1GABRB2AKR1B1MTNR1AALDH1A1
SCHEMBL27930641 0.76 ALDH1A1 (0.55) GABRA1GABRB2MTNR1AALDH1A1HSD17B10
SCHEMBL28831011 0.76 ALDH1A1 (0.45) GABRA1GABRB2MTNR1AALDH1A1HSD17B10
SCHEMBL4338851 0.75 MEN1 (0.37) GABRA1GABRB2SRD5A1ALDH1A1HSD17B10
SCHEMBL1685061 0.75 GABRA1 (0.45) GABRA1GABRB2AKR1B1SRD5A1MTNR1A

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 23 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0892774-A4 PYRONIN ANTIBACTERIALS, PROCESS AND NOVEL INTERMEDIATES THERETO ANADYS PHARMACEUTICALS INC (US) 2001-10-04 EP disclosed
US-6239291-B1 Pyronin antibacterials, process and novel intermediates thereto SCRIPTGEN PHARMACEUTICALS, INC. 2001-05-29 US disclosed
US-6228882-B1 MYXOPYRONINS AND CORALLOPYRONINS; RNA POLYMERASE INHIBITORS; SAPONIFICATION, ACIDIFICATION, AZIDING, ACYLATION ANADYS PHARMACEUTICALS, INC. 2001-05-08 US disclosed
US-6191288-B1 Pyronin antibacterials, process and novel intermediates thereto ANADYS PHARMACEUTICALS, INC. 2001-02-20 US disclosed
US-6184393-B1 MYXOPYRONINS AND CORALLOPYRONINS AS FURAN AND PYRAN- AND SMALL LACTONE-ANTIBIOTICS; INHIBITORS OF RNA POLYMERASE (RNAP) HAVING SELECTIVITY FOR HUMAN RNAP, CELL PENETRATION AND POTENCY AGAINST RIFAMPICIN-RESISTANT STAPH. AUREUS TRUSTEES OF BOSTON UNIVERSITY 2001-02-06 US disclosed
EP-1043990-A1 PYRONIN ANTIBACTERIALS, PROCESS AND NOVEL INTERMEDIATES THERETO Scriptgen Pharmaceuticals, Inc. (US) 2000-10-18 EP disclosed
US-6127551-A 4-HYDROXY-6-ETHYOXYCARBONYLALKENYL-2H-PYRAN-2-ONE IS ACYLATED WITH PROPIONYL CHLORIDE TO FORM A KETONE ADDUCT, FOLLOWED BY BASE-CATALYZED ALDOL TO FROM A PYRONE ALDOL; MESYLATION, FORM A PYRONE KETONE; AND CURTIUS SEQUENCE TO FORM MYXOPYRONIN SCRIPTGEN PHARMACEUTICALS, INC. (US) 2000-10-03 US disclosed
US-6090953-A PREPARING A MYXOPYRONIN SCRIPTGEN PHARMACEUTICALS, INC. (US) 2000-07-18 US disclosed
WO-2000015626-A1 PROCESS FOR THE PREPARATION OF INTERMEDIATES FOR PYRONIN ANTIBACTERIALS ANADYS PHARMACEUTICALS, INC. (US) 2000-03-23 WO disclosed
US-6022983-A PREPARING A MYXOPYRONIN SCRIPTGEN PHARMACEUTICALS, INC. (US) 2000-02-08 US disclosed
WO-1997034569-A2 PYRONIN ANTIBACTERIALS, PROCESS AND INTERMEDIATES SCRIPTGEN PHARMACEUTICALS, INC. (US) 1997-09-25 WO disclosed
EP-0173050-B1 SELECTED 2,2,6,6-TETRAMETHYL-4-PIPERIDINYL DERIVATIVES AND THEIR USE AS LIGHT STABILIZERS OLIN CORPORATION (US) 1991-11-13 EP disclosed
EP-0365539-A4 HUMAN LEUCOCYTE ELASTASE INHIBITOR COMPOUNDS 1990-12-05 EP disclosed
EP-0147211-B1 4H-3,1-BENZOXAZIN-4-ONES AND RELATED COMPOUNDS, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM, AND PROCESSES FOR THEIR PREPARATION SYNTEX (U.S.A.) INC. (US) 1990-09-12 EP disclosed
EP-0365539-A1 HUMAN LEUCOCYTE ELASTASE INHIBITOR COMPOUNDS AUSTRALIAN COMMERCIAL RESEARCH & DEVELOPMENT LIMITED (AU) 1990-05-02 EP disclosed
WO-1988010258-A1 HUMAN LEUCOCYTE ELASTASE INHIBITOR COMPOUNDS LA TROBE UNIVERSITY (AU) 1988-12-29 WO disclosed
US-4657893-A ANTIINFLAMMATORY AGENTS SYNTEX (U.S.A.) INC. (US) 1987-04-14 US disclosed
EP-0173050-A2 Selected 2,2,6,6-tetramethyl-4-piperidinyl derivatives and their use as light stabilizers OLIN CORPORATION (US) 1986-03-05 EP disclosed
US-4548973-A SUNSCREENS OLIN CORPORATION (US) 1985-10-22 US disclosed
EP-0147211-A2 4H-3,1-benzoxazin-4-ones and related compounds, pharmaceutical compositions containing them, and processes for their preparation SYNTEX (U.S.A.) INC. (US) 1985-07-03 EP disclosed