SCHEMBL5495313

SCHEMBL5495313

Cc1cc(C(c2ccc(Nc3ccccc3)cc2)c2ccc(Nc3ccccc3)cc2)ccc1N

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 12/20 0.50
TDP1 Q9NUW8 6/20 0.50
CYP3A4 P08684 6/20 0.50
ALOX15 P16050 4/20 0.50
THRB P10828 3/20 0.50
RECQL P46063 2/20 0.50
HIF1A Q16665 2/20 0.50
MAPT P10636 7/20 0.44
L3MBTL1 Q9Y468 4/20 0.44
ALOX12 P18054 4/20 0.44
CYP1A2 P05177 3/20 0.44
HPGD P15428 3/20 0.44
CYP2C9 P11712 2/20 0.44
CYP2C19 P33261 2/20 0.44
HTT P42858 1/20 0.44
HSD17B10 Q99714 6/20 0.42
TSHR P16473 4/20 0.42
MAPK1 P28482 2/20 0.42
PTGS1 P23219 1/20 0.42
SLC6A2 P23975 1/20 0.42

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
SCHEMBL29278568 0.86 CYP3A4 (0.45) ALDH1A1TDP1CYP3A4MAPTCYP2C9
SCHEMBL743578 0.86 CYP3A4 (0.45) ALDH1A1TDP1CYP3A4MAPTCYP2C9
SCHEMBL2127369 0.83 ALDH1A1 (0.70) ALDH1A1TDP1CYP3A4ALOX15THRB
SCHEMBL30998047 0.83 ALDH1A1 (0.70) ALDH1A1TDP1CYP3A4ALOX15THRB
SCHEMBL22044330 0.81 CYP3A4 (0.50) ALDH1A1TDP1CYP3A4ALOX15MAPT
SCHEMBL30749457 0.80 CYP3A4 (0.54) ALDH1A1TDP1CYP3A4ALOX15THRB
SCHEMBL5166514 0.80 CYP3A4 (0.54) ALDH1A1TDP1CYP3A4ALOX15THRB
SCHEMBL9658923 0.78 ALDH1A1 (0.68) ALDH1A1TDP1CYP3A4ALOX15THRB
SCHEMBL5495315 0.78 HPGD (0.50) ALDH1A1TDP1CYP3A4ALOX15THRB
SCHEMBL13070208 0.77 ALDH1A1 (0.46) ALDH1A1TDP1CYP3A4ALOX15THRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1765592-A1 METHOD FOR MAKING NEGATIVE-WORKING HEAT-SENSITIVE LITHOGRAPHIC PRINTING PLATE PRECURSOR Agfa Graphics N.V. (BE) 2007-03-28 EP disclosed
US-20060078802-A1 Holographic storage medium SABIC INNOVATIVE PLASTICS IP B.V. 2006-04-13 US disclosed
WO-2006005688-A1 METHOD FOR MAKING NEGATIVE-WORKING HEAT-SENSITIVE LITHOGRAPHIC PRINTING PLATE PRECURSOR. AGFA-GEVAERT (BE) 2006-01-19 WO disclosed
EP-0239868-B1 PHOTOCHROMIC SYSTEM, LAYER PREPARED THEREOF AND ITS USE BASF Aktiengesellschaft (DE) 1989-12-27 EP disclosed
US-4857438-A Photochromic system and layers produced therewith BASF AKTIENGESELLSCHAFT (DE) 1989-08-15 US disclosed
EP-0239868-A1 Photochromic system, layer prepared thereof and its use BASF Aktiengesellschaft (DE) 1987-10-07 EP disclosed
US-4332884-A USING A DIOXIME CHELATING AGENT RICOH CO., LTD. (JP) 1982-06-01 US disclosed
US-4306014-A AMMONIA OR AMINES SUPPRESS THE COLOR-FORMING REACTION SYSTEM RICOH CO., LTD. (JP) 1981-12-15 US disclosed
US-4251619-A Process for forming photo-polymeric image KONISHIROKU PHOTO INDUSTRY CO., LTD. (JP) 1981-02-17 US disclosed