SCHEMBL10654062

SCHEMBL10654062

CCOC(=O)CN1C(=O)CCc2ccc(F)cc21

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.50
CHRM1 P11229 2/20 0.48
NPSR1 Q6W5P4 1/20 0.47
PIN1 Q13526 1/20 0.47
PIN4 Q9Y237 1/20 0.47
HTT P42858 2/20 0.46
USP2 O75604 1/20 0.46
GSK3A P49840 1/20 0.44
GSK3B P49841 1/20 0.44
LOXL2 Q9Y4K0 1/20 0.44
PPARG P37231 1/20 0.44
ALDH1A1 P00352 2/20 0.43
KMT2A Q03164 2/20 0.43
MEN1 O00255 1/20 0.43
RAB9A P51151 1/20 0.43
POLB P06746 1/20 0.43
BRD4 O60885 1/20 0.42
MAPT P10636 1/20 0.41
HSD17B10 Q99714 1/20 0.41
CYP1A2 P05177 1/20 0.41

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
SCHEMBL10651491 0.90 LMNA (0.50) LMNACHRM1NPSR1PIN1PIN4
SCHEMBL10654004 0.86 PIN1 (0.43) LMNACHRM1NPSR1PIN1PIN4
SCHEMBL10129654 0.85 ATAD2 (0.51) LMNANPSR1PIN1PIN4HTT
SCHEMBL10650459 0.85 LMNA (0.68) LMNANPSR1PIN1PIN4HTT
SCHEMBL11231189 0.82 NPSR1 (0.61) LMNANPSR1HTTUSP2ALDH1A1
SCHEMBL10508437 0.81 CHRM1 (0.48) CHRM1HTTALDH1A1KMT2AMEN1
SCHEMBL10129647 0.81 PPARG (0.48) LMNANPSR1PIN1PIN4HTT
SCHEMBL10650996 0.78 NPSR1 (0.70) LMNANPSR1HTTUSP2PPARG
SCHEMBL10650463 0.78 HTT (0.75) NPSR1HTTUSP2ALDH1A1KMT2A
SCHEMBL4382637 0.78 ATAD2 (0.65) LMNANPSR1PIN1PIN4HTT

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-4755509-A Heterocyclic aldose reductase inhibitors and methods of using them Carbipem (FR) 1988-07-05 US disclosed