SCHEMBL20036720

SCHEMBL20036720

CCCCc1cc(N)n(-c2ccc(CO[Si](C)(C)C(C)(C)C)cc2)n1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 1/20 0.37
CNR2 P34972 1/20 0.37
ALOX5 P09917 1/20 0.36
POLB P06746 1/20 0.35
TLR7 Q9NYK1 3/20 0.35
NPC1 O15118 2/20 0.34
RAB9A P51151 2/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
NFKB1 P19838 1/20 0.34
NFKB2 Q00653 1/20 0.34
RELA Q04206 1/20 0.34
PDPK1 O15530 2/20 0.34
LMNA P02545 1/20 0.33
SKP2 Q13309 1/20 0.33
DHFR P00374 1/20 0.32
MEN1 O00255 1/20 0.31
TP53 P04637 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP3A4 P08684 1/20 0.31
MAPT P10636 1/20 0.31

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
SCHEMBL19731926 0.84 LMNA (0.39) CNR1CNR2ALOX5POLBTLR7
SCHEMBL27742972 0.80 NPC1 (0.51) CNR1CNR2ALOX5POLBTLR7
SCHEMBL2503008 0.80 POLB (0.38) POLBNPC1RAB9ASMN1; SMN2NFKB1
SCHEMBL27795718 0.79 CNR1 (0.44) CNR1CNR2ALOX5POLBTLR7
SCHEMBL17112756 0.78 MEN1 (0.45) CNR1CNR2ALOX5NPC1RAB9A
SCHEMBL19226006 0.78 CNR1 (0.38) CNR1CNR2ALOX5POLBTLR7
SCHEMBL27854827 0.78 CNR1 (0.43) CNR1CNR2ALOX5POLBTLR7
SCHEMBL31537082 0.78 CYP1A2 (0.49) POLBNPC1RAB9ASMN1; SMN2NFKB1
SCHEMBL19731925 0.78 MIF (0.46) CNR1CNR2ALOX5POLBTLR7
SCHEMBL2364213 0.76 NPC1 (0.53) CNR1CNR2ALOX5POLBTLR7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2509595-B1 INHIBITORS OF HEMOPOIETIC CELL KINASE (P59-HCK) AND THEIR USE IN THE TREATMENT OF INFLUENZA INFECTION RESPIVERT LTD (GB) 2018-04-11 EP disclosed