SCHEMBL4807602

SCHEMBL4807602

CC(=O)c1ccc(N)c(C)c1C

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 2/20 0.39
TSHR P16473 1/20 0.39
PIK3CA P42336 1/20 0.39
BRD4 O60885 1/20 0.39
THRB P10828 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
KDM4E B2RXH2 3/20 0.36
KMT2A Q03164 3/20 0.36
TDP1 Q9NUW8 3/20 0.36
MEN1 O00255 2/20 0.36
GABRP O00591 1/20 0.35
GABRD O14764 1/20 0.35
GABRA1 P14867 1/20 0.35
GABRB1 P18505 1/20 0.35
GABRG2 P18507 1/20 0.35
GABRB3 P28472 1/20 0.35
GABRA5 P31644 1/20 0.35
GABRA3 P34903 1/20 0.35
GABRA2 P47869 1/20 0.35
GABRB2 P47870 1/20 0.35

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
SCHEMBL6232283 0.84 CYP3A4 (0.40) CYP3A4TSHRPIK3CATHRBKDM4E
SCHEMBL481149 0.83 MAPT (0.45) CYP3A4TSHRPIK3CABRD4THRB
SCHEMBL93998 0.82 KDM4E (0.50) CYP3A4THRBKDM4EKMT2ATDP1
SCHEMBL30340194 0.82 KDM4E (0.50) CYP3A4THRBKDM4EKMT2ATDP1
SCHEMBL5783182 0.82 PARP1 (0.42) CYP3A4TSHRPIK3CABRD4KDM4E
SCHEMBL25522125 0.81 MAPT (0.38) CYP3A4TSHRBRD4THRBSMN1; SMN2
SCHEMBL12384997 0.81 ALDH1A1 (0.38) CYP3A4TSHRPIK3CABRD4THRB
SCHEMBL836606 0.80 CYP3A4 (0.54) CYP3A4TSHRPIK3CABRD4SMN1; SMN2
SCHEMBL28695987 0.80 CYP3A4 (0.37) CYP3A4TSHRPIK3CATHRBKDM4E
SCHEMBL17059399 0.78 BRD4 (0.34) CYP3A4TSHRPIK3CABRD4THRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7365104-B2 Light curable articles containing azinium salts EASTMAN KODAK COMPANY (US) 2008-04-29 US disclosed
US-20060223902-A1 Light curable articles containing azinium salts EASTMAN KODAK COMPANY 2006-10-05 US disclosed
US-6242057-B1 GENERATING PHOTOINITIATORS KIMBERLY-CLARK WORLDWIDE, INC. 2001-06-05 US disclosed