SCHEMBL5884533

SCHEMBL5884533

C=CCON=Cc1ccc(OCC2CCN(c3ccc(Cl)nn3)CC2)cc1

nearest known ligand 0.38

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.38
HTT P42858 1/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
BPTF Q12830 1/20 0.37
CHRNB2 P17787 3/20 0.36
CHRNA4 P43681 3/20 0.36
CHRNB4 P30926 2/20 0.36
CHRNA3 P32297 2/20 0.36
CYP1A2 P05177 1/20 0.36
PANK3 Q9H999 2/20 0.34

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
SCHEMBL5884258 0.91 LMNA (0.36) LMNAHTTMEN1KMT2ASMN1; SMN2
SCHEMBL5884266 0.90 KMT2A (0.41) LMNAHTTMEN1KMT2ASMN1; SMN2
SCHEMBL5884712 0.90 LMNA (0.36) LMNAHTTMEN1KMT2ASMN1; SMN2
SCHEMBL5884903 0.89 CHRNB2 (0.36) LMNAHTTMEN1KMT2ASMN1; SMN2
SCHEMBL5884503 0.85 DGAT1 (0.40) LMNAHTTMEN1KMT2ASMN1; SMN2
SCHEMBL5883893 0.83 AXL (0.41) LMNAHTTMEN1KMT2ASMN1; SMN2
SCHEMBL5884797 0.82 CHRNB2 (0.35) LMNAHTTMEN1KMT2ASMN1; SMN2
SCHEMBL5884927 0.81 CHRNB2 (0.34) LMNAHTTMEN1KMT2ASMN1; SMN2
SCHEMBL5883827 0.81 KMT2A (0.40) LMNAHTTMEN1KMT2ASMN1; SMN2
SCHEMBL5884253 0.81 KMT2A (0.40) LMNAHTTMEN1KMT2ASMN1; SMN2

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