SCHEMBL2911080

SCHEMBL2911080

CCCCONCCc1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 3/20 0.56
HPGD P15428 2/20 0.53
ALDH1A1 P00352 2/20 0.53
RAB9A P51151 3/20 0.51
MEN1 O00255 3/20 0.51
KMT2A Q03164 3/20 0.51
NPC1 O15118 2/20 0.51
ATM Q13315 1/20 0.47
TAAR1 Q96RJ0 1/20 0.47
SMN1; SMN2 Q16637 2/20 0.44
MAPT P10636 1/20 0.44
NFKB1 P19838 1/20 0.44
NFKB2 Q00653 1/20 0.44
RELA Q04206 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.43
HDAC3 O15379 1/20 0.43
TSHR P16473 1/20 0.43

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
SCHEMBL28475113 0.95 SIGMAR1 (0.59) SIGMAR1HPGDALDH1A1RAB9AMEN1
Hydrochloric Acid SCHEMBL10616388 0.92 SIGMAR1 (0.56) SIGMAR1HPGDALDH1A1RAB9AMEN1
SCHEMBL8897396 0.89 SIGMAR1 (0.50) SIGMAR1HPGDALDH1A1RAB9AMEN1
SCHEMBL5532769 0.86 SIGMAR1 (0.53) SIGMAR1HPGDMEN1KMT2AL3MBTL1
SCHEMBL27481442 0.83 SIGMAR1 (0.54) SIGMAR1HPGDMEN1KMT2AL3MBTL1
SCHEMBL6570269 0.83 SIGMAR1 (0.38) SIGMAR1HPGDALDH1A1RAB9AMEN1
SCHEMBL5501337 0.81 ALDH1A1 (0.47) SIGMAR1HPGDALDH1A1MEN1KMT2A
SCHEMBL6570225 0.81 ALDH1A1 (0.43) SIGMAR1HPGDALDH1A1RAB9AMEN1
SCHEMBL1258404 0.81 ATM (0.54) SIGMAR1ALDH1A1RAB9AMEN1KMT2A
Iodide SCHEMBL21800796 0.79 ATM (0.52) SIGMAR1ALDH1A1RAB9AMEN1KMT2A

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-2220100-A2 CHIRAL CYCLOPLATINIZED COMPLEXES, METHOD FOR THE PRODUCTION THEREOF AND THEIR USE IN MEDICINE AND CATALYSTS Rheinisch-Westfälisch-Technische Hochschule Aachen (DE) 2010-08-25 EP disclosed
WO-2009077462-A2 CHIRAL CYCLOPLATINIZED COMPLEXES, METHOD FOR THE PRODUCTION THEREOF AND THEIR USE IN MEDICINE AND CATALYSTS Rheinisch-Westfälische Technische Hochschule Aachen (DE) 2009-06-25 WO disclosed
EP-0789577-A4 SYNTHESIS OF N-SUBSTITUTED OLIGOMERS CHIRON CORP (US) 1998-07-22 EP disclosed
EP-0789577-A1 SYNTHESIS OF N-SUBSTITUTED OLIGOMERS CHIRON CORPORATION (US) 1997-08-20 EP disclosed
EP-0671928-A4 SYNTHESIS OF N-SUBSTITUTED OLIGOMERS. CHIRON CORP (US) 1997-04-23 EP disclosed
WO-1996040202-A1 SYNTHESIS OF N-SUBSTITUTED OLIGOMERS CHIRON CORPORATION (US) 1996-12-19 WO disclosed
EP-0671928-A1 SYNTHESIS OF N-SUBSTITUTED OLIGOMERS CHIRON CORPORATION (US) 1995-09-20 EP disclosed
WO-1995004072-A1 PEPTOID ALPHA-1 ADRENERGIC RECEPTOR LIGANDS CHIRON CORPORATION (US) 1995-02-09 WO disclosed
WO-1994006451-A1 SYNTHESIS OF N-SUBSTITUTED OLIGOMERS CHIRON CORPORATION (US) 1994-03-31 WO disclosed