SCHEMBL5185602

SCHEMBL5185602

CCCNC(=N)c1cc(C(=O)O)c2c3ccc4c5c(ccc(c6ccc(C(=O)NCCC)c1c62)c53)C(=O)NC4=O

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CASP3 P42574 1/20 0.35
▸ POLB P06746 2/20 0.35
▸ L3MBTL1 Q9Y468 2/20 0.35
▸ THRB P10828 1/20 0.35
▸ RECQL P46063 1/20 0.35
▸ TDP1 Q9NUW8 1/20 0.35
▸ KDM4E B2RXH2 4/20 0.33
▸ ALDH1A1 P00352 4/20 0.33
▸ HPGD P15428 4/20 0.33
▸ GAA P10253 1/20 0.32
▸ MAOB P27338 1/20 0.32
▸ KCNA3 P22001 1/20 0.32
▸ CHEK1 O14757 1/20 0.32
▸ ALOX5 P09917 1/20 0.31
▸ KMT2A Q03164 4/20 0.31
▸ HSD17B10 Q99714 1/20 0.31
▸ ALOX12 P18054 1/20 0.30
▸ MEN1 O00255 1/20 0.30
▸ LMNA P02545 1/20 0.30
▸ MAPT P10636 1/20 0.30

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
SCHEMBL1095842 0.93 ALOX5 (0.39) POLBL3MBTL1KDM4EALDH1A1HPGD
SCHEMBL2524404 0.93 ALOX5 (0.39) POLBL3MBTL1KDM4EALDH1A1HPGD
SCHEMBL6561059 0.90 HTT (0.39) KDM4EALDH1A1CHEK1HSD17B10HTT
SCHEMBL9511404 0.89 KDM4E (0.38) L3MBTL1RECQLTDP1KDM4EALDH1A1
SCHEMBL5187338 0.88 ALDH1A1 (0.41) POLBL3MBTL1KDM4EALDH1A1HPGD
SCHEMBL5577030 0.86 HTT (0.36) POLBTHRBKMT2AHSD17B10MEN1
SCHEMBL5576815 0.85 TP53 (0.40) POLBTHRBTDP1KDM4EGAA
SCHEMBL2683123 0.84 CHEK1 (0.31) CHEK1KMT2AMEN1
SCHEMBL10341193 0.83 CHEK1 (0.47) CASP3KDM4EALDH1A1HPGDCHEK1
SCHEMBL2867820 0.83 TAS1R3 (0.31) KDM4EALDH1A1HPGDHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6319645-B1 USEFUL IN ELECTROPHOTOGRAPHIC IMAGING AND PRINTING XEROX CORPORATION 2001-11-20 — — US claimed
EP-1235117-B1 Imaging members XEROX CORP (US) 2007-07-11 — — EP disclosed
EP-1235117-A1 Imaging members Xerox Corporation (US) 2002-08-28 — — EP disclosed
US-6319645-B1 USEFUL IN ELECTROPHOTOGRAPHIC IMAGING AND PRINTING XEROX CORPORATION 2001-11-20 — — US disclosed
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