SCHEMBL6400994

SCHEMBL6400994

COc1ccc2c(c1)C(C)(C)c1c3c(c4cc(OC)ccc4c1-2)OC(c1ccccc1)(c1ccccc1OCCO)C=C3

nearest known ligand 0.32

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALK Q9UM73 5/20 0.32
MEN1 O00255 2/20 0.31
LMNA P02545 2/20 0.31
TSHR P16473 2/20 0.31
KMT2A Q03164 2/20 0.31
PLIN1 O60240 1/20 0.31
GAA P10253 1/20 0.31
MAPT P10636 1/20 0.31
THRB P10828 1/20 0.31
PKM P14618 1/20 0.31
RECQL P46063 1/20 0.31
PLIN5 Q00G26 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
ABHD5 Q8WTS1 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
CYP11B1 P15538 1/20 0.30
CYP11B2 P19099 1/20 0.30
SIRT1 Q96EB6 1/20 0.30
KDM4E B2RXH2 1/20 0.30
ALDH1A1 P00352 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
SCHEMBL1010106 0.95 ALK (0.30) ALK
SCHEMBL1009643 0.91 ALK (0.35) ALKMEN1LMNATSHRKMT2A
SCHEMBL3704719 0.88 MEN1 (0.31) ALKMEN1LMNATSHRKMT2A
SCHEMBL30708919 0.88 MEN1 (0.31) ALKMEN1LMNATSHRKMT2A
SCHEMBL1009814 0.87 FFAR1 (0.33) ALK
SCHEMBL1009670 0.87 KDM4E (0.36) ALKMEN1LMNATSHRKMT2A
SCHEMBL1009637 0.86 ALK (0.32) ALKMAPTKDM4E
SCHEMBL8510608 0.85 MEN1 (0.32) ALKMEN1LMNATSHRKMT2A
SCHEMBL25529849 0.85 KDM4E (0.35) MEN1LMNATSHRKMT2AMAPT
SCHEMBL13988246 0.84 ALK (0.40) ALK

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-20050258408-A1 Photochromic contact lenses and methods for their production MOLOCK FRANK F 2005-11-24 US disclosed