SCHEMBL4249454

SCHEMBL4249454

OC(Cn1cncn1)Cn1cncn1

nearest known ligand 0.55

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.50
HPGD P15428 1/20 0.50
FDPS P14324 1/20 0.46
EGLN3 Q9H6Z9 1/20 0.45
CYP19A1 P11511 3/20 0.41
HSP90AA1 P07900 1/20 0.39
HDAC1 Q13547 1/20 0.39
HDAC6 Q9UBN7 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
SCHEMBL21317693 0.89 POLB (0.47) POLBHPGDFDPSEGLN3CYP19A1
SCHEMBL28168250 0.87 POLB (0.46) POLBHPGDFDPSEGLN3CYP19A1
SCHEMBL13108577 0.87 POLB (0.46) POLBHPGDFDPSEGLN3CYP19A1
SCHEMBL12900040 0.87 POLB (0.46) POLBHPGDFDPSEGLN3CYP19A1
SCHEMBL6898380 0.86
SCHEMBL10771116 0.86 POLB (0.44) POLBHPGDFDPSEGLN3CYP19A1
SCHEMBL5606579 0.84 POLB (0.43) POLBHPGDFDPSEGLN3CYP19A1
SCHEMBL18538766 0.82 POLB (0.43) POLBHPGDFDPSEGLN3CYP19A1
SCHEMBL16433861 0.82 POLB (0.52) POLBHPGDEGLN3CYP19A1
SCHEMBL20516158 0.82

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0618198-B1 Process for the preparation of derivatives of 1-(1,2,4-triazol-1-yl)-propan-2-ol TEVA PHARMA (IL) 2000-05-03 EP claimed
US-5484936-A Processes for the preparation of 1,3-bis(1,2,4-triazol-1-yl)-propan-2-ol derivatives TEVA PHARMACEUTICAL INDUSTRIES LTD. (IL) 1996-01-16 US claimed
EP-0618198-A1 Process for the preparation of 1,3-bis (1,2,4-triazol-1-yl)-propan-2-ol derivatives TEVA PHARMACEUTICAL INDUSTRIES LTD. (IL) 1994-10-05 EP claimed
JP-6340637-A None JP disclosed
JP-6340637-A None JP disclosed
US-8753875-B2 Compositions and means for diagnosing microbial infections STATENS SERUM INSTITUT (DK) 2014-06-17 US disclosed
US-20090068696-A1 COMPOSITIONS AND MEANS FOR DIAGNOSING MICROBIAL INFECTIONS STATENS SERUM INSTITUT 2009-03-12 US disclosed
EP-0618198-B1 Process for the preparation of derivatives of 1-(1,2,4-triazol-1-yl)-propan-2-ol TEVA PHARMA (IL) 2000-05-03 EP disclosed
EP-0831815-A1 USE OF BIS-1,2,4-TRIAZOLES FOR THE MANUFACTURE OF A MEDICAMENT FOR THE TREATMENT OF CANCERS THE PROCTER & GAMBLE COMPANY (US) 1998-04-01 EP disclosed
WO-1996040120-A1 USE OF BIS-1,2,4-TRIAZOLES FOR THE MANUFACTURE OF A MEDICAMENT FOR THE TREATMENT OF CANCERS THE PROCTER & GAMBLE COMPANY (US) 1996-12-19 WO disclosed
US-5484936-A Processes for the preparation of 1,3-bis(1,2,4-triazol-1-yl)-propan-2-ol derivatives TEVA PHARMACEUTICAL INDUSTRIES LTD. (IL) 1996-01-16 US disclosed
US-5484936-A Processes for the preparation of 1,3-bis(1,2,4-triazol-1-yl)-propan-2-ol derivatives TEVA PHARMACEUTICAL INDUSTRIES LTD. (IL) 1996-01-16 US disclosed
US-5484936-A Processes for the preparation of 1,3-bis(1,2,4-triazol-1-yl)-propan-2-ol derivatives TEVA PHARMACEUTICAL INDUSTRIES LTD. (IL) 1996-01-16 US disclosed
JP-H06340637-A PREPARATION OF 1,3-BIS(1,2,4-TRIAZOL-1-YL)-PROPAN-2-OL DERIVATIVE TEVA PHARMACEUT IND LTD 1994-12-13 JP disclosed
JP-H06340637-A PREPARATION OF 1,3-BIS(1,2,4-TRIAZOL-1-YL)-PROPAN-2-OL DERIVATIVE TEVA PHARMACEUT IND LTD 1994-12-13 JP disclosed
EP-0618198-A1 Process for the preparation of 1,3-bis (1,2,4-triazol-1-yl)-propan-2-ol derivatives TEVA PHARMACEUTICAL INDUSTRIES LTD. (IL) 1994-10-05 EP disclosed
EP-0618198-A1 Process for the preparation of 1,3-bis (1,2,4-triazol-1-yl)-propan-2-ol derivatives TEVA PHARMACEUTICAL INDUSTRIES LTD. (IL) 1994-10-05 EP disclosed
EP-0618198-A1 Process for the preparation of 1,3-bis (1,2,4-triazol-1-yl)-propan-2-ol derivatives TEVA PHARMACEUTICAL INDUSTRIES LTD. (IL) 1994-10-05 EP disclosed
US-4618616-A MAMMALS AND PLANTS; 1,2,4-TRIAZOLE DI-SUBSTITUTED PFIZER INC. (US) 1986-10-21 US disclosed
US-4510148-A 2-Heterocyclic-1,3-bis(1H-1,2,4-triazol-1-yl)-propan-2-ols as antifungal agents PFIZER INC. (US) 1985-04-09 US disclosed