SCHEMBL7239552

SCHEMBL7239552

CCc1nc(-c2cccnc2)cn1-c1ccc(NCc2c(F)cccc2Cl)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.46
KDM4E B2RXH2 4/20 0.46
KMT2A Q03164 3/20 0.46
MAPT P10636 3/20 0.46
L3MBTL1 Q9Y468 3/20 0.46
MEN1 O00255 2/20 0.46
MAPK1 P28482 1/20 0.46
MPI P34949 1/20 0.46
RXFP1 Q9HBX9 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
TSHR P16473 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
TP53 P04637 2/20 0.39
GAA P10253 2/20 0.39
JAK2 O60674 1/20 0.39
JAK1 P23458 1/20 0.39
TYK2 P29597 1/20 0.39
JAK3 P52333 1/20 0.39
LCK P06239 4/20 0.38
BTK Q06187 4/20 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
SCHEMBL7241783 0.90 PTGS2 (0.37) ALDH1A1KDM4EKMT2AMAPTL3MBTL1
SCHEMBL7234972 0.85 L3MBTL1 (0.45) ALDH1A1KDM4EKMT2AMAPTL3MBTL1
SCHEMBL7634838 0.82 MAPT (0.46) ALDH1A1KDM4EKMT2AMAPTL3MBTL1
SCHEMBL7241965 0.80 EPHX2 (0.56) ALDH1A1KDM4EKMT2AMAPTL3MBTL1
SCHEMBL7237050 0.78 FYN (0.43) ALDH1A1MAPTSMN1; SMN2TSHRHTT
SCHEMBL7243590 0.76 PTGS2 (0.39) ALDH1A1KDM4EKMT2AMAPTL3MBTL1
SCHEMBL7235296 0.76 ALDH1A1 (0.45) ALDH1A1KDM4EKMT2AMAPTL3MBTL1
SCHEMBL7242287 0.74 MAPT (0.45) ALDH1A1KDM4EKMT2AMAPTL3MBTL1
SCHEMBL7244587 0.73 VCP (0.37)
SCHEMBL7638011 0.72 MAPT (0.45) ALDH1A1KDM4EKMT2AMAPTL3MBTL1

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-6627647-B1 Substituted 1-(4-aminophenyl)imidazoles and their use as anti-inflammatory agents BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. 2003-09-30 US claimed
WO-2001070703-A2 SUBSTITUTED 1-(4-AMINOPHENYL)IMIDAZOLES AND THEIR USE AS ANTI-INFLAMMATORY AGENTS BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. (US) 2001-09-27 WO claimed