SCHEMBL6842263

SCHEMBL6842263

CC(C)Nc1ccc(C(=O)c2ccc(N(C)C)cc2)cc1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.66
HPGD P15428 5/20 0.66
MAPT P10636 4/20 0.66
RAB9A P51151 6/20 0.58
NPC1 O15118 4/20 0.58
TP53 P04637 3/20 0.50
KDM4E B2RXH2 2/20 0.50
LMNA P02545 1/20 0.50
MCL1 Q07820 1/20 0.50
HSD17B10 Q99714 1/20 0.50
KMT2A Q03164 5/20 0.45
SMN1; SMN2 Q16637 4/20 0.45
HDAC1 Q13547 2/20 0.45
HDAC6 Q9UBN7 2/20 0.45
HTT P42858 2/20 0.44
MEN1 O00255 3/20 0.44
HDAC3 O15379 1/20 0.44
HDAC4 P56524 1/20 0.44
HDAC7 Q8WUI4 1/20 0.44
HDAC2 Q92769 1/20 0.44

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
SCHEMBL194039 0.87 RXFP1 (0.53) ALDH1A1HPGDMAPTRAB9ANPC1
SCHEMBL8705589 0.85 ALDH1A1 (0.52) ALDH1A1HPGDMAPTRAB9ANPC1
SCHEMBL6841746 0.82 KMT2A (0.55) ALDH1A1MAPTRAB9ANPC1TP53
Michler'S Ketone SCHEMBL36517 0.81 ALDH1A1 (1.00) ALDH1A1HPGDMAPTRAB9ANPC1
SCHEMBL274966 0.81 ALDH1A1 (1.00) ALDH1A1HPGDMAPTRAB9ANPC1
SCHEMBL11479190 0.81 ALDH1A1 (0.68) ALDH1A1HPGDMAPTRAB9ANPC1
SCHEMBL24627774 0.80 MAPT (0.73) ALDH1A1HPGDMAPTRAB9ANPC1
SCHEMBL1615179 0.80 ALDH1A1 (0.65) ALDH1A1HPGDMAPTRAB9ANPC1
SCHEMBL10612153 0.80 TDP1 (0.46) ALDH1A1HPGDMAPTRAB9ANPC1
Michler'S Ketone SCHEMBL11758312 0.79 ALDH1A1 (0.95) ALDH1A1HPGDMAPTRAB9ANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6797841-B2 HAVING PHOTOINITIATION ACTIVITY WITH MINIMAL OR NO ADVERSE HAZARDOUS CHARACTERISTICS ALBEMARLE CORPORATION 2004-09-28 US claimed
US-6762323-B2 EXPOSING A FORMUALTION CONTAINING A PIGMENT AND A PHOTOPOLYMERIZABLE COMPOUND HAVING AN ETHYLENICALLY UNSATURATED DOUBLE BOND TO RADIATION IN PRESENCE NON-MUTAGENIC PHOTOINITIATOR ALBEMARLE CORPORATION 2004-07-13 US claimed
US-20030078313-A1 Aminobenzophenones and photopolymerizable compositions including the same ALBEMARLE CORPORATION 2003-04-24 US claimed
US-20030065049-A1 Aminobenzophenones and photopolymerizable compositions including the same ALBEMARLE CORPORATION 2003-04-03 US claimed
US-6479706-B1 Aminobenzophenones and photopolymerizable compositions including the same ALBEMARLE CORPORATION 2002-11-12 US claimed
US-6479706-B1 Aminobenzophenones and photopolymerizable compositions including the same ALBEMARLE CORPORATION 2002-11-12 US disclosed