SCHEMBL5884301

SCHEMBL5884301

CCON=Cc1ccc(OCCC2CCN(c3ccc(Cl)nn3)CC2)c(OC)c1

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.40
KMT2A Q03164 2/20 0.39
LMNA P02545 4/20 0.39
ALDH1A1 P00352 2/20 0.39
MEN1 O00255 1/20 0.38
MAPT P10636 4/20 0.38
HPGD P15428 2/20 0.38
AMY1A P0DUB6 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2C19 P33261 1/20 0.38
DRD2 P14416 1/20 0.37
DRD4 P21917 1/20 0.37
HTR4 Q13639 1/20 0.37
KDM4E B2RXH2 1/20 0.36
POLB P06746 1/20 0.36
ADRB2 P07550 1/20 0.36
NPC1 O15118 1/20 0.36
RAB9A P51151 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
SCHEMBL5883897 0.92 LMNA (0.41) SMN1; SMN2KMT2ALMNAALDH1A1MEN1
SCHEMBL5884125 0.90 HPGD (0.37) SMN1; SMN2KMT2ALMNAALDH1A1MEN1
SCHEMBL5884679 0.89 LMNA (0.41) SMN1; SMN2KMT2ALMNAALDH1A1MEN1
SCHEMBL5884632 0.86 HPGD (0.41) SMN1; SMN2KMT2ALMNAALDH1A1MEN1
SCHEMBL5883827 0.86 KMT2A (0.40) SMN1; SMN2KMT2ALMNAALDH1A1MEN1
SCHEMBL5884253 0.86 KMT2A (0.40) SMN1; SMN2KMT2ALMNAALDH1A1MEN1
SCHEMBL5884132 0.84 LMNA (0.39) SMN1; SMN2KMT2ALMNAALDH1A1MEN1
SCHEMBL5884586 0.84 SMN1; SMN2 (0.37) SMN1; SMN2KMT2ALMNAALDH1A1MEN1
SCHEMBL5884478 0.83 MEN1 (0.40) SMN1; SMN2KMT2ALMNAALDH1A1MEN1
SCHEMBL5884620 0.83 HPGD (0.35) SMN1; SMN2KMT2ALMNAALDH1A1MEN1

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