SCHEMBL810605

SCHEMBL810605

C=C(I)N1CCCCCCCC1=O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.44
MITF O75030 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
KDM4E B2RXH2 3/20 0.35
GAA P10253 1/20 0.35
POLB P06746 1/20 0.35
MAPT P10636 3/20 0.33
ALDH1A1 P00352 3/20 0.33
KMT2A Q03164 2/20 0.33
HSD17B10 Q99714 2/20 0.33
TP53 P04637 2/20 0.33
STAT6 P42226 1/20 0.33
MEN1 O00255 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP2D6 P10635 1/20 0.33
THRB P10828 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33
RECQL P46063 1/20 0.33
BLM P54132 1/20 0.33

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
SCHEMBL628971 0.91
SCHEMBL20065224 0.81 LMNA (0.50) LMNAMITFSMN1; SMN2KDM4EGAA
SCHEMBL6822537 0.79 SMN1; SMN2 (0.45) LMNAMITFSMN1; SMN2KDM4EGAA
SCHEMBL7277181 0.77 LMNA (0.45) LMNAMITFSMN1; SMN2KDM4EGAA
SCHEMBL22043008 0.77 LMNA (0.45) LMNAMITFSMN1; SMN2KDM4EGAA
SCHEMBL11276999 0.76 LMNA (0.46) LMNAMITFSMN1; SMN2KDM4EGAA
SCHEMBL2440165 0.76 LMNA (0.41) LMNAMITFSMN1; SMN2KDM4EGAA
SCHEMBL8379227 0.76 LMNA (0.54) LMNAMITFSMN1; SMN2KDM4EGAA
SCHEMBL5181091 0.76 LMNA (0.54) LMNAMITFSMN1; SMN2KDM4EGAA
SCHEMBL131845 0.76 LMNA (0.54) LMNAMITFSMN1; SMN2KDM4EGAA

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
EP-2404951-A1 Polymerizable siloxane-quaternary amine copolymers BAUSCH & LOMB INCORPORATED (US) 2012-01-11 EP disclosed