SCHEMBL8897587

SCHEMBL8897587

COc1ccc(C(=O)C(Cc2ccccc2)(Cc2ccc(CC(Cc3ccccc3)(C(=O)c3ccc(OC)cc3)N(C)C)cc2)N(C)C)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 1/20 0.57
RAB9A P51151 5/20 0.51
NPC1 O15118 5/20 0.51
CES2 O00748 1/20 0.47
CES1 P23141 1/20 0.47
TAS2R14 Q9NYV8 2/20 0.47
PTGES O14684 1/20 0.47
TAS2R8 Q9NYW2 1/20 0.47
CXCR3 P49682 1/20 0.47
LTA4H P09960 1/20 0.46
MAPK1 P28482 1/20 0.46
PLAU P00749 1/20 0.46
ELANE P08246 1/20 0.46
ALDH1A1 P00352 2/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
MAPT P10636 1/20 0.46
SIGMAR1 Q99720 1/20 0.45
MMP1 P03956 1/20 0.45
MMP13 P45452 1/20 0.45
MEN1 O00255 1/20 0.45

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
SCHEMBL4651504 0.92 ACHE (0.51) ACHERAB9ANPC1CES2CES1
SCHEMBL4651502 0.89 ACHE (0.48) ACHERAB9ANPC1CES2CES1
SCHEMBL8899530 0.86 ACHE (0.51) ACHERAB9ANPC1CES2CES1
SCHEMBL8899791 0.85 KMT2A (0.44) RAB9ANPC1CES1ALDH1A1SMN1; SMN2
SCHEMBL8631398 0.84 ACHE (0.43) ACHERAB9ANPC1CES2CES1
SCHEMBL8961820 0.83 RAB9A (0.48) ACHERAB9ANPC1CES2CES1
SCHEMBL18678829 0.82 NPC1 (0.45) RAB9ANPC1CES2CES1TAS2R14
SCHEMBL14156794 0.82 NPY5R (0.47) ACHERAB9ANPC1PTGESALDH1A1
SCHEMBL8898870 0.81 MLYCD (0.45) RAB9ANPC1TAS2R14ALDH1A1SMN1; SMN2
SCHEMBL8900778 0.81 KMT2A (0.55) RAB9ANPC1MAPK1ALDH1A1SMN1; SMN2

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-5629356-A PHOTOCURABLE COMPOSITION CONTAINING ETHYLENICALLY UNSATURATED PHOTOPOLYMERIZABLE COMPOUND AND THE AMINOACETOPHENONE CIBA GEIGY CORPORATION (US) 1997-05-13 US disclosed
US-5554663-A α-aminoacetophenones as photoinitiators CIBA-GEIGY CORPORATION (US) 1996-09-10 US disclosed
US-5534629-A PHOTOPOLYMERIZATION OF PIGMENTED SYSTEMS, INKS CIBA-GEIGY CORPORATION (US) 1996-07-09 US disclosed
EP-0284561-B1 ALPHA-AMINOACETOPHENONES AS PHOTO INITIATORS CIBA-GEIGY AG (CH) 1993-05-12 EP disclosed
US-5077402-A For photocuring pigmented systems; printing inks, lacquers CIBA-GEIGY CORPORATION (US) 1991-12-31 US disclosed
EP-0284561-A2 Alpha-aminoacetophenones as photo initiators CIBA-GEIGY AG (CH) 1988-09-28 EP disclosed