SCHEMBL6472686

SCHEMBL6472686

C=C(C)COc1c(OCCCC)cc(C(C)(C)c2cc(OCCCC)c(OCC(=C)C)c(OCCCC)c2OCCCC)c(OCCCC)c1OCCCC

nearest known ligand 0.37

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ACE2 Q9BYF1 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.34
MEN1 O00255 1/20 0.32
ALDH1A1 P00352 1/20 0.32
POLB P06746 1/20 0.32
KMT2A Q03164 1/20 0.32
SLC6A5 Q9Y345 1/20 0.32
ESR1 P03372 1/20 0.31
THRA P10827 1/20 0.31
THRB P10828 1/20 0.31
RXRA P19793 1/20 0.30
PPARG P37231 1/20 0.30

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
SCHEMBL6473448 0.93 MEN1 (0.32) ACE2SMN1; SMN2MEN1ALDH1A1POLB
SCHEMBL6473086 0.85 TSHR (0.36) ACE2SMN1; SMN2MEN1ALDH1A1POLB
SCHEMBL6473509 0.82 ALDH1A1 (0.38) ACE2SMN1; SMN2ALDH1A1POLBESR1
SCHEMBL11139673 0.81 ALDH1A1 (0.34) SMN1; SMN2MEN1ALDH1A1POLBKMT2A
SCHEMBL6472692 0.81 TSHR (0.36) ACE2SMN1; SMN2ALDH1A1POLBKMT2A
SCHEMBL6295611 0.79 MEN1 (0.33) SMN1; SMN2MEN1KMT2A
SCHEMBL9316178 0.78 ALDH1A1 (0.38) SMN1; SMN2MEN1ALDH1A1POLBKMT2A
SCHEMBL3946616 0.75 KDM4E (0.39) SMN1; SMN2ALDH1A1POLB
SCHEMBL392038 0.74 MEN1 (0.34) SMN1; SMN2MEN1ALDH1A1KMT2ARXRA
SCHEMBL6386501 0.71 MAPT (0.33) SMN1; SMN2MEN1KMT2ARXRAPPARG

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
WO-2005016983-A1 COATING SYSTEM CONTAINING (METH)ACRYLATE SIKA TECHNOLOGY AG (CH) 2005-02-24 WO disclosed