SCHEMBL14504271

SCHEMBL14504271

C#Cc1cccc(Nc2nc(N3CCCCC3)nc(N3CCCCC3)n2)c1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.66
SMN1; SMN2 Q16637 1/20 0.66
HTT P42858 3/20 0.64
NPSR1 Q6W5P4 1/20 0.63
MAPT P10636 3/20 0.60
IDH2 P48735 1/20 0.58
ALDH1A1 P00352 1/20 0.55
KMT2A Q03164 5/20 0.54
MEN1 O00255 3/20 0.54
ALOX15 P16050 1/20 0.54
TSHR P16473 1/20 0.54
HSD17B10 Q99714 1/20 0.54
GAA P10253 1/20 0.53
TAAR1 Q96RJ0 1/20 0.53
NPC1 O15118 1/20 0.53
RAB9A P51151 1/20 0.53
GBA1 P04062 4/20 0.49
PTGS2 P35354 1/20 0.48
TP53 P04637 1/20 0.47
POLB P06746 1/20 0.47

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
SCHEMBL6234951 0.80 CTSK (0.61) LMNASMN1; SMN2HTTNPSR1MAPT
SCHEMBL5425121 0.80 IDH2 (0.47) LMNASMN1; SMN2HTTNPSR1MAPT
SCHEMBL22627074 0.80 ABCG2 (0.51) MAPTIDH2ALDH1A1
SCHEMBL14503558 0.80 LMNA (0.71) LMNASMN1; SMN2HTTNPSR1MAPT
SCHEMBL11584606 0.77 LMNA (0.67) LMNASMN1; SMN2HTTNPSR1MAPT
SCHEMBL14503837 0.76 LMNA (0.70) LMNASMN1; SMN2HTTNPSR1MAPT
SCHEMBL14503049 0.76 LMNA (0.66) LMNASMN1; SMN2HTTNPSR1MAPT
SCHEMBL14503144 0.76 NPSR1 (0.94) LMNASMN1; SMN2HTTNPSR1MAPT
SCHEMBL11807869 0.75 NPSR1 (0.93) LMNASMN1; SMN2HTTNPSR1MAPT
SCHEMBL14503554 0.75 NPSR1 (0.70) LMNASMN1; SMN2HTTNPSR1MAPT

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-7223759-B2 Antibacterial 3,5-diaminopiperidine-substituted aromatic and heteroaromatic compounds ANADYS PHARMACEUTICALS, INC. (US) 2007-05-29 US disclosed
US-7223759-B2 Antibacterial 3,5-diaminopiperidine-substituted aromatic and heteroaromatic compounds ANADYS PHARMACEUTICALS, INC. (US) 2007-05-29 US disclosed