SCHEMBL7689507

SCHEMBL7689507

Cc1c[nH]c(CCCO)c1

nearest known ligand 0.42

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HMBS P08397 1/20 0.41
DAO P14920 2/20 0.36
KDM4E B2RXH2 2/20 0.33
POLB P06746 1/20 0.33
HPGD P15428 1/20 0.33
GPR84 Q9NQS5 1/20 0.31
TNKS2 Q9H2K2 1/20 0.31

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
SCHEMBL28822944 0.81 HRH3 (0.44) HMBSDAOKDM4EHPGDGPR84
SCHEMBL25922583 0.78
SCHEMBL13117522 0.76
SCHEMBL3417110 0.72 NPSR1 (0.47) HMBSDAOHPGD
SCHEMBL23315141 0.71 DAO (0.43) HMBSDAO
SCHEMBL80615 0.69 TNKS2 (0.47) KDM4EPOLBHPGDTNKS2
SCHEMBL18521877 0.69
SCHEMBL20201824 0.68 DAO (0.43) HMBSDAO
SCHEMBL3668498 0.67 CYP4F2 (0.46) KDM4E
SCHEMBL10122677 0.67 HRH4 (0.59) DAOKDM4EPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0623134-B1 METAL COMPLEXES OF WATER SOLUBLE TEXAPHYRINS UNIV TEXAS (US) 2002-11-06 EP disclosed
US-5994535-A Water soluble texaphyrin metal complex preparation BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 1999-11-30 US disclosed
US-5733903-A ANTITUMOR AGENTS WITH DIAMAGNETISM BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 1998-03-31 US disclosed
US-5569759-A MAGNETIC RESONANCE IMAGING; TUMOR THERAPY BOARD OF REGENTS, UNIVERSITY OF TEXAS SYSTEM (US) 1996-10-29 US disclosed
US-5504205-A MACROMOLECULAR PORPHYRINS; WATER SOLUBILITY, LIPOPHILIC BOARD OF REGENTS, UNIVERSITY OF TEXAS SYSTEM (US) 1996-04-02 US disclosed
US-5475104-A Useful in magnetic resonance imaging; detection tumors, cancer cells; transition and lanthanide metals BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 1995-12-12 US disclosed
US-5457183-A Radiosensitizers BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 1995-10-10 US disclosed
US-5451576-A Tumor imaging and treatment by water soluble texaphyrin metal complexes BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 1995-09-19 US disclosed
US-5439570-A Destroying tumors, viruses; magnetic resonance imaging BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 1995-08-08 US disclosed
US-5432171-A Water soluble texaphyrin metal complexes for viral deactivation BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 1995-07-11 US disclosed
EP-0623134-A1 METAL COMPLEXES OF WATER SOLUBLE TEXAPHYRINS BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 1994-11-09 EP disclosed
US-5252720-A Medical uses BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 1993-10-12 US disclosed
WO-1993014093-A1 METAL COMPLEXES OF WATER SOLUBLE TEXAPHYRINS BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 1993-07-22 WO disclosed