SCHEMBL3367704

SCHEMBL3367704

C=Cc1ccccc1OC(C)OC(C)C

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.36
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
CYP3A4 P08684 1/20 0.35
ADRA2B P18089 3/20 0.33
ADRA2C P18825 3/20 0.33
LMNA P02545 2/20 0.33
ADRA2A P08913 2/20 0.33
MAPK1 P28482 2/20 0.33
NPC1 O15118 1/20 0.33
MAPT P10636 1/20 0.33
RAB9A P51151 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
AR P10275 1/20 0.33
PTGES2 Q9H7Z7 1/20 0.33
IRAK4 Q9NWZ3 1/20 0.33
SLC22A1 O15245 1/20 0.31
CYP1A2 P05177 1/20 0.31

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
SCHEMBL419697 0.86 ALDH1A1 (0.43) ALDH1A1MEN1KMT2ACYP3A4ADRA2B
SCHEMBL1397111 0.86 MEN1 (0.32) ALDH1A1MEN1KMT2ACYP3A4NFE2L2
SCHEMBL7642123 0.85 ALDH1A1 (0.40) ALDH1A1MEN1KMT2ACYP3A4ADRA2B
SCHEMBL27744776 0.82 ADRA2B (0.33) ALDH1A1MEN1KMT2ACYP3A4ADRA2B
SCHEMBL29266724 0.82 LMNA (0.33) ALDH1A1MEN1KMT2ACYP3A4ADRA2B
SCHEMBL6377765 0.81 ALDH1A1 (0.44) ALDH1A1MEN1KMT2ACYP3A4ADRA2B
SCHEMBL6322964 0.80 LMNA (0.38) ALDH1A1MEN1KMT2ACYP3A4ADRA2B
SCHEMBL19971519 0.79 ALDH1A1 (0.38) ALDH1A1MEN1KMT2ACYP3A4ADRA2B
SCHEMBL8004381 0.79 ALDH1A1 (0.34) ALDH1A1MEN1KMT2ACYP3A4ADRA2B
SCHEMBL1395548 0.79 LMNA (0.37) ALDH1A1MEN1KMT2ACYP3A4ADRA2B

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1320785-B1 OXIME DERIVATIVES AND THE USE THEREOF AS LATENT ACIDS BASF SE (DE) 2010-02-17 EP disclosed
CN-1751269-A Halogenated oxime derivatives and their use as latent acids CIBA SC HOLDING AG (CH) 2006-03-22 CN disclosed
CN-1628268-A Sulfonic acid derivatives and their use as latent acids CIBA SC HOLDING AG (CH) 2005-06-15 CN disclosed