SCHEMBL8897288

SCHEMBL8897288

C=CCC(Cc1ccccc1)(C(=O)c1ccc(SC)cc1)N(C)C

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TAS2R14 Q9NYV8 1/20 0.40
KMT2A Q03164 4/20 0.39
LMNA P02545 3/20 0.39
MAPT P10636 2/20 0.39
NPSR1 Q6W5P4 1/20 0.39
MEN1 O00255 2/20 0.38
ALDH1A1 P00352 6/20 0.37
RAB9A P51151 2/20 0.36
NPC1 O15118 1/20 0.36
AKR1C3 P42330 1/20 0.36
AKR1C2 P52895 1/20 0.36
AKR1C1 Q04828 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
MLYCD O95822 1/20 0.35
DRD2 P14416 1/20 0.35
DRD4 P21917 1/20 0.35
HPGD P15428 2/20 0.34
TBXA2R P21731 1/20 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
SCHEMBL8898857 0.89 ALDH1A1 (0.41) KMT2ALMNAMEN1ALDH1A1RAB9A
SCHEMBL8898996 0.87 ALDH1A1 (0.40) KMT2ALMNAMAPTNPSR1MEN1
SCHEMBL8898301 0.86 PPARG (0.39) KMT2ALMNAMAPTMEN1ALDH1A1
SCHEMBL8898163 0.85 KMT2A (0.47) KMT2ALMNAMAPTMEN1ALDH1A1
SCHEMBL8898574 0.85 MLYCD (0.39) TAS2R14ALDH1A1RAB9ANPC1CYP3A4
SCHEMBL8897938 0.85 TAS2R14 (0.43) TAS2R14KMT2ALMNAMAPTNPSR1
SCHEMBL8898294 0.84 HPGD (0.38) KMT2ALMNAMAPTMEN1ALDH1A1
SCHEMBL8898609 0.84 ALDH1A1 (0.37) KMT2ALMNAMAPTNPSR1MEN1
SCHEMBL8900879 0.81 KMT2A (0.42) KMT2ALMNAMAPTALDH1A1RAB9A
SCHEMBL28190381 0.79 ALDH1A1 (0.46) KMT2ALMNAMAPTMEN1ALDH1A1

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