SCHEMBL28815529

SCHEMBL28815529

C1=CCN(c2ccc(N3CCOCC3)cc2)C1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.67
MAPT P10636 8/20 0.65
ALDH1A1 P00352 6/20 0.65
NPC1 O15118 5/20 0.65
RAB9A P51151 5/20 0.65
MEN1 O00255 3/20 0.65
KMT2A Q03164 3/20 0.65
HTT P42858 3/20 0.65
CYP1A2 P05177 1/20 0.65
KDM4E B2RXH2 6/20 0.57
ALOX15 P16050 2/20 0.57
HSD17B10 Q99714 2/20 0.57
TP53 P04637 2/20 0.57
USP2 O75604 1/20 0.57
MAPK1 P28482 1/20 0.57
TSHR P16473 2/20 0.55
PKM P14618 1/20 0.55
HPGD P15428 3/20 0.53
LGMN Q99538 1/20 0.52
CNR2 P34972 1/20 0.50

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
SCHEMBL9093746 0.89 LMNA (0.71) LMNAMAPTALDH1A1NPC1RAB9A
SCHEMBL2175616 0.82 LMNA (0.62) LMNAMAPTALDH1A1NPC1RAB9A
SCHEMBL3948094 0.82 LMNA (0.95) LMNAMAPTALDH1A1NPC1RAB9A
SCHEMBL2555823 0.82 LMNA (0.95) LMNAMAPTALDH1A1NPC1RAB9A
SCHEMBL254812 0.82 LMNA (0.95) LMNAMAPTALDH1A1NPC1RAB9A
Ammonia Solution, Strong SCHEMBL4262260 0.80 LMNA (0.91) LMNAMAPTALDH1A1NPC1RAB9A
Hydrochloric Acid SCHEMBL9131024 0.80 LMNA (0.91) LMNAMAPTALDH1A1NPC1RAB9A
SCHEMBL184087 0.80 LMNA (0.91) LMNAMAPTALDH1A1NPC1RAB9A
SCHEMBL9092806 0.80 LMNA (0.60) LMNAMAPTALDH1A1NPC1RAB9A
SCHEMBL13809379 0.80 LMNA (1.00) LMNAMAPTALDH1A1NPC1RAB9A

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
CN-104185420-A Antiviral JAK inhibitors for the treatment or prevention of retroviral and other viral infections UNIV EMORY 2014-12-03 CN claimed