SCHEMBL30454901

SCHEMBL30454901

COc1cc(Br)ccc1CC#N

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PYCR1 P32322 1/20 0.51
CSNK2A1 P68400 2/20 0.45
KDM4E B2RXH2 2/20 0.43
TDP1 Q9NUW8 2/20 0.43
GAA P10253 2/20 0.38
MAPT P10636 2/20 0.38
HTT P42858 2/20 0.38
TSHR P16473 2/20 0.38
MAPK1 P28482 1/20 0.38
MEN1 O00255 1/20 0.38
USP2 O75604 1/20 0.38
ALDH1A1 P00352 1/20 0.38
THRB P10828 1/20 0.38
ALOX15 P16050 1/20 0.38
CASP1 P29466 1/20 0.38
RECQL P46063 1/20 0.38
BLM P54132 1/20 0.38
KMT2A Q03164 1/20 0.38
HSD17B10 Q99714 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38

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
SCHEMBL425131 1.00 PYCR1 (0.51) PYCR1CSNK2A1KDM4ETDP1GAA
SCHEMBL4171690 0.86 KDM4E (0.50) CSNK2A1KDM4ETDP1GAAMAPT
SCHEMBL14097993 0.84 SLC6A4 (0.43) PYCR1CSNK2A1KDM4ETDP1
SCHEMBL27869012 0.83 PYCR1 (0.49) PYCR1KDM4ETDP1CASP1HSD17B10
SCHEMBL15820790 0.83 CSNK2A1 (0.43) PYCR1CSNK2A1TDP1GAAMAPT
SCHEMBL15820910 0.80 HPGD (0.46) PYCR1CSNK2A1KDM4EGAAMAPT
SCHEMBL12257908 0.80 ACHE (0.50) KDM4ETDP1GAAMAPTHTT
SCHEMBL1237860 0.80 APLNR (0.58) MAPTTSHRALDH1A1
SCHEMBL6674914 0.79 MAPT (0.65) KDM4EGAAMAPTHTTTSHR
SCHEMBL8032757 0.79 MAOB (0.50) GAAMAPTHTTTSHRMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119315217-A Hybrid separator and electrochemical device including the same SK新技术株式会社 2025-01-14 CN claimed
CN-115151553-B Boric acid derivatives 首药控股(北京)股份有限公司 2025-06-13 CN disclosed
CN-119315217-A Hybrid separator and electrochemical device including the same SK新技术株式会社 2025-01-14 CN disclosed
CN-116143708-A Polysubstituted benzazepine heteroaryl derivative and application thereof 四川汇宇制药股份有限公司 2023-05-23 CN disclosed