SCHEMBL11503568

SCHEMBL11503568

COC(=O)C(C#N)=Cc1ccc(CBr)cc1

nearest known ligand 0.54

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.50
KDM4E B2RXH2 5/20 0.50
MAPT P10636 3/20 0.50
KMT2A Q03164 3/20 0.50
TDP1 Q9NUW8 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
HPGD P15428 2/20 0.48
GAA P10253 1/20 0.47
PKM P14618 1/20 0.47
HTT P42858 1/20 0.47
MEN1 O00255 2/20 0.46
LMNA P02545 2/20 0.46
ADORA2A P29274 1/20 0.46
ADORA2B P29275 1/20 0.46
ADORA1 P30542 1/20 0.46
DNM1 Q05193 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
SCHEMBL11503567 1.00 ALDH1A1 (0.50) ALDH1A1KDM4EMAPTKMT2ATDP1
SCHEMBL10413551 0.87 KDM4E (0.59) ALDH1A1KDM4EMAPTKMT2ATDP1
SCHEMBL10413552 0.87 KDM4E (0.59) ALDH1A1KDM4EMAPTKMT2ATDP1
SCHEMBL21457628 0.87 ALDH1A1 (0.60) ALDH1A1KDM4EMAPTKMT2ATDP1
SCHEMBL21457632 0.87 ALDH1A1 (0.60) ALDH1A1KDM4EMAPTKMT2ATDP1
SCHEMBL8999262 0.86 ALDH1A1 (0.67) ALDH1A1KDM4EMAPTKMT2ATDP1
SCHEMBL8999255 0.86 ALDH1A1 (0.67) ALDH1A1KDM4EMAPTKMT2ATDP1
SCHEMBL21457305 0.83 ALDH1A1 (0.53) ALDH1A1KDM4EMAPTKMT2ATDP1
SCHEMBL21457302 0.83 ALDH1A1 (0.53) ALDH1A1KDM4EMAPTKMT2ATDP1
SCHEMBL782201 0.81 ALDH1A1 (0.65) ALDH1A1KDM4EMAPTKMT2ATDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4159270-A Bichromophoric benzotriazole-styrene ultraviolet stabilizers EASTMAN KODAK COMPANY (US) 1979-06-26 US disclosed
US-4070337-A Bichromophoric benzotriazole-styrene ultraviolet stabilizers and their use in organic compositions EASTMAN KODAK COMPANY (US) 1978-01-24 US disclosed