SCHEMBL8899013

SCHEMBL8899013

CCCCN(CCCC)C(CC)(Cc1ccccc1)C(=O)c1ccc(SC)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TAS2R14 Q9NYV8 1/20 0.39
HPGD P15428 2/20 0.36
GAA P10253 1/20 0.36
MAPT P10636 2/20 0.36
KMT2A Q03164 2/20 0.36
LMNA P02545 2/20 0.36
NPSR1 Q6W5P4 1/20 0.36
RAB9A P51151 2/20 0.36
NPC1 O15118 1/20 0.36
HDAC1 Q13547 2/20 0.35
HDAC6 Q9UBN7 2/20 0.35
TAS1R3 Q7RTX0 1/20 0.34
TAS1R1 Q7RTX1 1/20 0.34
MLYCD O95822 1/20 0.34
MEN1 O00255 1/20 0.34
THRA P10827 1/20 0.34
THRB P10828 1/20 0.34
LIMK1 P53667 1/20 0.34
LIMK2 P53671 1/20 0.34
ALDH1A1 P00352 3/20 0.34

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
SCHEMBL8897938 0.84 TAS2R14 (0.43) TAS2R14HPGDGAAMAPTKMT2A
SCHEMBL8899045 0.78 SMN1; SMN2 (0.44) GAAMAPTKMT2ALMNARAB9A
SCHEMBL727211 0.77 TSHR (0.43) HPGDGAAMAPTKMT2ALMNA
SCHEMBL9010278 0.76 SMN1; SMN2 (0.43) GAAMAPTKMT2ALMNARAB9A
SCHEMBL8898371 0.75 THRB (0.50) KMT2AHDAC1HDAC6THRATHRB
SCHEMBL8897532 0.74 THRB (0.45) MAPTKMT2ARAB9ANPC1HDAC1
SCHEMBL8897288 0.73 TAS2R14 (0.40) TAS2R14HPGDGAAMAPTKMT2A
SCHEMBL1595027 0.72 CNR2 (0.43) GAANPSR1RAB9ANPC1MLYCD
SCHEMBL28033176 0.71 ALDH1A1 (0.39) TAS2R14HPGDMAPTKMT2ARAB9A
SCHEMBL8899559 0.71 HDAC1 (0.39) HPGDKMT2AHDAC1HDAC6MLYCD

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