SCHEMBL11222652

SCHEMBL11222652

CC(=O)C(CN1CCCCC1)c1ccccc1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MITF O75030 3/20 0.66
SMN1; SMN2 Q16637 3/20 0.66
ALDH1A1 P00352 2/20 0.66
RAB9A P51151 2/20 0.66
HTT P42858 1/20 0.66
GFER P55789 1/20 0.66
PAX8 Q06710 1/20 0.66
ATM Q13315 1/20 0.66
NTSR1 P30989 1/20 0.60
LMNA P02545 2/20 0.59
HIF1A Q16665 1/20 0.59
MAPT P10636 1/20 0.53
NLRP1 Q9C000 1/20 0.53
POLB P06746 1/20 0.52
CYP3A4 P08684 1/20 0.50
CYP2D6 P10635 1/20 0.50
TSHR P16473 1/20 0.50
CYP2C19 P33261 1/20 0.50
OPRK1 P41145 1/20 0.50
NPC1 O15118 1/20 0.49

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
SCHEMBL17616735 0.98 MITF (0.68) MITFSMN1; SMN2ALDH1A1RAB9AHTT
SCHEMBL2596926 0.87 ALDH1A1 (0.69) MITFSMN1; SMN2ALDH1A1RAB9AHTT
SCHEMBL27772020 0.87 ALDH1A1 (0.69) MITFSMN1; SMN2ALDH1A1RAB9AHTT
Hydrochloric Acid SCHEMBL2551763 0.85 ALDH1A1 (0.72) MITFSMN1; SMN2ALDH1A1RAB9AHTT
SCHEMBL12282101 0.85 MITF (0.71) MITFSMN1; SMN2ALDH1A1RAB9AHTT
SCHEMBL7592795 0.85 MITF (0.71) MITFSMN1; SMN2ALDH1A1RAB9AHTT
SCHEMBL1683001 0.84 LMNA (0.64) MITFSMN1; SMN2ALDH1A1RAB9AHTT
SCHEMBL2552921 0.83 ALDH1A1 (0.61) MITFSMN1; SMN2ALDH1A1RAB9AHTT
SCHEMBL6321267 0.83 SMN1; SMN2 (0.94) MITFSMN1; SMN2ALDH1A1RAB9AHTT
SCHEMBL684723 0.83 NTSR1 (0.59) MITFSMN1; SMN2ALDH1A1RAB9AHTT

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-4333941-A Inhibition of enveloped viruses with phenyl ketones THE DOW CHEMICAL COMPANY (US) 1982-06-08 US claimed