SCHEMBL5884475

SCHEMBL5884475

CON=Cc1ccc(OCCC2CCN(c3nc(OC)nc(OC)n3)CC2)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.41
MAPT P10636 4/20 0.40
SMN1; SMN2 Q16637 2/20 0.39
LMNA P02545 2/20 0.39
CYP1A2 P05177 1/20 0.38
CYP2D6 P10635 1/20 0.38
CYP2C19 P33261 1/20 0.38
GFER P55789 1/20 0.38
POLB P06746 1/20 0.38
JAK2 O60674 2/20 0.37
SYK P43405 2/20 0.37
GAA P10253 2/20 0.36
KDM4E B2RXH2 1/20 0.36
APAF1 O14727 1/20 0.36
NSD2 O96028 1/20 0.36
HTT P42858 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
SENP8 Q96LD8 1/20 0.36
SENP7 Q9BQF6 1/20 0.36
SENP6 Q9GZR1 1/20 0.36

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
SCHEMBL5883969 0.92 MAPT (0.39) TDP1MAPTSMN1; SMN2LMNAPOLB
SCHEMBL5884624 0.83 GPR119 (0.44) GAA
SCHEMBL5884362 0.80 NR1I2 (0.38) MAPTGAAL3MBTL1MAOBTEAD1
SCHEMBL5884332 0.79 KMT2A (0.39) CYP1A2CYP2C19GAAKDM4ENPSR1
SCHEMBL5884261 0.78 PPARG (0.37) MAPTSMN1; SMN2GAANPSR1TEAD1
SCHEMBL5884262 0.78 GPR119 (0.37) GAANPSR1ALDH1A1L3MBTL1TEAD1
SCHEMBL5884268 0.78 MEN1 (0.43) SMN1; SMN2LMNACYP1A2HTTALDH1A1
SCHEMBL5884324 0.77 PPARG (0.46) MAPTSMN1; SMN2CYP1A2CYP2D6CYP2C19
SCHEMBL5883853 0.77 ATP4A (0.42) MAPTSMN1; SMN2LMNAPOLBGAA
SCHEMBL5884304 0.76 HTT (0.39) HTTALDH1A1

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
US-7078403-B1 Antiviral agents BIOTA SCIENTIFIC MANAGEMENT PTY LTD. (AU) 2006-07-18 US claimed