SCHEMBL7930685

SCHEMBL7930685

Cc1cc(C#N)cc(C)c1[NH]

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TTR P02766 2/20 0.41
ALB P02768 2/20 0.41
ALDH1A1 P00352 3/20 0.40
CYP2A6 P11509 2/20 0.40
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
KDM4E B2RXH2 2/20 0.34
MAPT P10636 1/20 0.34
HPGD P15428 1/20 0.34
ALOX15 P16050 1/20 0.34
HSD17B10 Q99714 1/20 0.34
APOBEC3G Q9HC16 1/20 0.34
HAVCR2 Q8TDQ0 1/20 0.34
EGLN2 Q96KS0 2/20 0.34
VCAM1 P19320 2/20 0.33
TSHR P16473 3/20 0.32
HDAC8 Q9BY41 1/20 0.32
RECQL P46063 1/20 0.31
AR P10275 3/20 0.31
RAF1 P04049 1/20 0.30

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
SCHEMBL6954472 0.78 TTR (0.44) TTRALBALDH1A1CYP2A6MEN1
SCHEMBL2153449 0.78 TTR (0.44) TTRALBALDH1A1CYP2A6MEN1
SCHEMBL2153883 0.76 KDM4E (0.45) TTRALBALDH1A1CYP2A6MEN1
SCHEMBL1484862 0.74 MAOA (0.46) TTRALBALDH1A1CYP2A6MEN1
SCHEMBL12158706 0.74 TTR (0.41) TTRALBALDH1A1CYP2A6MEN1
SCHEMBL23505827 0.74 TTR (0.52) TTRALBALDH1A1CYP2A6MEN1
SCHEMBL2421383 0.74 TTR (0.46) TTRALBALDH1A1CYP2A6MEN1
SCHEMBL197918 0.74 TTR (0.58) TTRALBALDH1A1CYP2A6MEN1
SCHEMBL16649897 0.74 TTR (0.41) TTRALBALDH1A1CYP2A6MEN1
SCHEMBL25370179 0.74 CYP2A6 (0.46) TTRALBALDH1A1CYP2A6MEN1

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
EP-0661350-B1 Quinizarin compound, method for production thereof, and use therefor NIPPON CATALYTIC CHEM IND (JP) 2001-08-22 EP disclosed
US-5968688-A RESINS AND DYES FOR COLOR FILTERS NIPPON SHOKUBAI CO., LTD. (JP) 1999-10-19 US disclosed
US-5817843-A Quinizarin compound, method for production thereof, and use therefor NIPPON SHOKUBAI CO., LTD. (JP) 1998-10-06 US disclosed
EP-0833203-A1 Color filter grade photosensitive resin coloring composition, and color filter using the same NIPPON SHOKUBAI CO., LTD. (JP) 1998-04-01 EP disclosed
US-5608091-A SHEETS FOR HEAT EXCHANGING AND OPTICAL RECORDING MATERIAL NIPPON SHOKUBAI CO., LTD. (JP) 1997-03-04 US disclosed
EP-0661350-A1 Quinizarin compound, method for production thereof, and use therefor NIPPON SHOKUBAI CO., LTD. (JP) 1995-07-05 EP disclosed