SCHEMBL5159013

SCHEMBL5159013

c1ccc(-c2ccc3nc4cc(-c5ccccc5)ccc4nc3c2)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIK3CA P42336 2/20 0.59
PIK3R1 P27986 1/20 0.59
BACE1 P56817 1/20 0.53
L3MBTL1 Q9Y468 3/20 0.50
NQO2 P16083 3/20 0.50
ALDH1A1 P00352 3/20 0.50
KMT2A Q03164 2/20 0.50
KDM4E B2RXH2 2/20 0.50
GAA P10253 2/20 0.50
ATM Q13315 1/20 0.50
TLR9 Q9NR96 1/20 0.50
DHFR P00374 1/20 0.50
PI4KA P42356 1/20 0.50
PI4KB Q9UBF8 1/20 0.50
MAPT P10636 2/20 0.48
NPC1 O15118 2/20 0.46
MEN1 O00255 1/20 0.46
USP2 O75604 1/20 0.46
POLB P06746 1/20 0.46
CACNA1B Q00975 1/20 0.46

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
SCHEMBL5157311 0.98 PIK3CA (0.58) PIK3CAPIK3R1BACE1L3MBTL1NQO2
SCHEMBL18805364 0.91 PIK3CA (0.56) PIK3CAPIK3R1BACE1L3MBTL1NQO2
SCHEMBL7173382 0.90 NQO2 (0.62) PIK3CAPIK3R1BACE1L3MBTL1NQO2
SCHEMBL27734154 0.89 ALDH1A1 (0.66) PIK3CAPIK3R1BACE1L3MBTL1ALDH1A1
SCHEMBL12462566 0.89 ALDH1A1 (0.66) PIK3CAPIK3R1BACE1L3MBTL1ALDH1A1
Hydrochloric Acid SCHEMBL6265381 0.87 NQO2 (0.59) PIK3CAPIK3R1BACE1L3MBTL1NQO2
SCHEMBL19306662 0.87 TDP1 (0.56) PIK3CAPIK3R1BACE1L3MBTL1ALDH1A1
SCHEMBL1301829 0.86 ALDH1A1 (0.68) PIK3CAPIK3R1L3MBTL1ALDH1A1KMT2A
SCHEMBL13818412 0.85 NQO2 (0.56) PIK3CAPIK3R1BACE1L3MBTL1NQO2
SCHEMBL23181683 0.85 PIK3R1 (0.47) PIK3CAPIK3R1BACE1L3MBTL1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1457813-B1 An improved electrochromic medium capable of producing a pre-selected color GENTEX CORP (US) 2007-01-24 EP disclosed
EP-1457813-A2 An improved electrochromic medium capable of producing a pre-selected color Gentex Corporation (US) 2004-09-15 EP disclosed
EP-0972227-B1 AN IMPROVED ELECTROCHROMIC MEDIUM CAPABLE OF PRODUCING A PRE-SELECTED COLOR GENTEX CORP (US) 2004-07-14 EP disclosed
US-6037471-A FOR ELECTROCHROMIC MIRRORS FOR MOTOR VEHICLES GENTEX CORPORATION (US) 2000-03-14 US disclosed
US-6020987-A Electrochromic medium capable of producing a pre-selected color GENTEX CORPORATION (US) 2000-02-01 US disclosed
EP-0972227-A1 AN IMPROVED ELECTROCHROMIC MEDIUM CAPABLE OF PRODUCING A PRE-SELECTED COLOR GENTEX CORPORATION (US) 2000-01-19 EP disclosed
US-5998617-A MIXTURE OF ELECTROACTIVE MATERIALS AT PRESELECTIVE CONCENTRATION; GRAY COLOR GENTEX CORPORATION (US) 1999-12-07 US disclosed
WO-1998044384-A1 AN IMPROVED ELECTROCHROMIC MEDIUM CAPABLE OF PRODUCING A PRE-SELECTED COLOR GENTEX CORPORATION (US) 1998-10-08 WO disclosed