SCHEMBL28525543

SCHEMBL28525543

CCOC(=O)c1cc(N2CCC(CC)CC2C)ccc1[N+](=O)[O-]

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.50
ALDH1A1 P00352 3/20 0.50
SIRT6 Q8N6T7 1/20 0.43
GALR2 O43603 1/20 0.39
MITF O75030 1/20 0.39
LMNA P02545 1/20 0.39
POLB P06746 1/20 0.39
HSP90AA1 P07900 1/20 0.39
HPGD P15428 1/20 0.39
XBP1 P17861 1/20 0.39
CCR6 P51684 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
KMT2A Q03164 1/20 0.39
VCAM1 P19320 1/20 0.39
MGLL Q99685 5/20 0.38
NPC1 O15118 1/20 0.38
GPR174 Q9BXC1 1/20 0.37

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
SCHEMBL28525542 1.00 MAPT (0.50) MAPTALDH1A1SIRT6GALR2MITF
SCHEMBL29800663 1.00 MAPT (0.50) MAPTALDH1A1SIRT6GALR2MITF
SCHEMBL28533547 1.00 MAPT (0.50) MAPTALDH1A1SIRT6GALR2MITF
SCHEMBL29800608 1.00 MAPT (0.50) MAPTALDH1A1SIRT6GALR2MITF
SCHEMBL28525541 1.00 MAPT (0.50) MAPTALDH1A1SIRT6GALR2MITF
SCHEMBL28533550 1.00 MAPT (0.50) MAPTALDH1A1SIRT6GALR2MITF
SCHEMBL29800273 0.90 MAPT (0.52) MAPTALDH1A1SIRT6GALR2MITF
SCHEMBL29800266 0.90 MAPT (0.52) MAPTALDH1A1SIRT6GALR2MITF
SCHEMBL28535079 0.88 MAPT (0.44) MAPTALDH1A1SIRT6LMNASMN1; SMN2
SCHEMBL28535077 0.88 MAPT (0.44) MAPTALDH1A1SIRT6LMNASMN1; 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
CN-112469707-A Prophylactic or therapeutic agent for spinal muscular atrophy 利伯纳生物科学株式会社 2021-03-09 CN disclosed