SCHEMBL6865547

SCHEMBL6865547

COc1ccc(Cc2ccc(OC)c(N)c2)cc1N

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 1.00
ALDH1A1 P00352 7/20 0.70
CA2 P00918 1/20 0.65
CYP3A4 P08684 1/20 0.57
MAPT P10636 2/20 0.55
MEN1 O00255 1/20 0.55
THRB P10828 1/20 0.55
KMT2A Q03164 1/20 0.55
PARP1 P09874 1/20 0.51
HTT P42858 2/20 0.50
LMNA P02545 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
TUBB4A P04350 1/20 0.49
TUBB P07437 1/20 0.49
TUBA3C P0DPH7 1/20 0.49
TUBA1B P68363 1/20 0.49
TUBA4A P68366 1/20 0.49
TUBB4B P68371 1/20 0.49
TUBB3 Q13509 1/20 0.49
TUBB2A Q13885 1/20 0.49

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
SCHEMBL18214084 0.92 ALDH1A1 (0.85) GAAALDH1A1CA2CYP3A4MAPT
SCHEMBL31090146 0.87 GAA (0.77) GAAALDH1A1CA2CYP3A4MAPT
SCHEMBL25128162 0.86 GAA (0.74) GAAALDH1A1CA2CYP3A4MAPT
SCHEMBL357294 0.85 GAA (0.74) GAAALDH1A1CA2CYP3A4MAPT
SCHEMBL29712870 0.85 GAA (0.74) GAAALDH1A1CA2CYP3A4MAPT
SCHEMBL1725006 0.85 GAA (0.74) GAAALDH1A1CA2CYP3A4MAPT
SCHEMBL31697662 0.85 GAA (0.72) GAAALDH1A1CA2CYP3A4MAPT
SCHEMBL8485615 0.84 GAA (0.72) GAAALDH1A1CA2CYP3A4MAPT
SCHEMBL9660217 0.84 CA2 (0.74) GAAALDH1A1CA2CYP3A4HTT
SCHEMBL12510496 0.83 GAA (0.71) GAAALDH1A1CA2CYP3A4MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10280334-B2 Polyimides, coating composition formed therefrom and use thereof ETERNAL MATERIALS CO., LTD. (TW) 2019-05-07 US disclosed
US-20160326301-A1 CURING AGENTS FOR EPOXY RESINS HEXCEL COMPOSITES LIMITED (GB) 2016-11-10 US disclosed
US-20160326301-A1 CURING AGENTS FOR EPOXY RESINS HEXCEL COMPOSITES LIMITED (GB) 2016-11-10 US disclosed
US-20140228512-A1 POLYIMIDES, COATING COMPOSITION FORMED THEREFROM AND USE THEREOF ETERNAL CHEMICAL CO., LTD. (TW) 2014-08-14 US disclosed
EP-2098226-A1 AKAP-PKA interaction inhibitors for use in the treatment of heart diseases Forschungsverbund Berlin e.V. (DE) 2009-09-09 EP disclosed
US-6808766-B1 ALIGNMENT AGENT COMPRISING POLYURETHANE OR POLYUREA, USED IN ALIGNMENT OF LIQUID CRYSTAL MOLECULES THAT FORM LIQUID CRYSTAL ALIGNMENT FILM BY IRRADIATING THIN ALIGNMENT FILM FORMED ON SUBSTRATE WITH POLARIZED LIGHT OR ELECTRON RAYS NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2004-10-26 US disclosed
EP-1111442-A1 TREATING AGENT FOR LIQUID CRYSTAL ALIGNMENT LAYER AND LIQUID CRYSTAL DEVICE USING THE SAME, AND METHOD FOR ALIGNMENT OF LIQUID CRYSTAL Nissan Chemical Industries, Ltd. (JP) 2001-06-27 EP disclosed