SCHEMBL7910874

SCHEMBL7910874

C=CCCC(CCC=C)(O[Si](C)(C)C)C(=O)c1ccccc1

nearest known ligand 0.37

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CES1 P23141 2/20 0.37
SRC P12931 1/20 0.37
ALDH1A1 P00352 5/20 0.37
LMNA P02545 1/20 0.37
HPGD P15428 1/20 0.37
KDM4E B2RXH2 2/20 0.36
AKT1 P31749 1/20 0.36
MAPK1 P28482 1/20 0.35
POLB P06746 1/20 0.35
TSHR P16473 2/20 0.35
L3MBTL1 Q9Y468 2/20 0.34
MEN1 O00255 1/20 0.34
CYP3A4 P08684 1/20 0.34
KMT2A Q03164 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
LSS P48449 2/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
ELANE P08246 1/20 0.34
GAA P10253 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
SCHEMBL7905899 0.75 SRC (0.41) CES1SRCALDH1A1LMNAHPGD
SCHEMBL11288752 0.75 CES1 (0.41) CES1SRCALDH1A1LMNAMAPK1
SCHEMBL10385943 0.71 CES1 (0.46) CES1SRCALDH1A1LMNAMAPK1
SCHEMBL7906884 0.70 ELANE (0.37) ALDH1A1LMNAKDM4ETSHRMEN1
SCHEMBL9142751 0.69 CES1 (0.38) CES1SRCALDH1A1LMNAMAPK1
SCHEMBL13963534 0.69 ALDH1A1 (0.39) CES1SRCALDH1A1LMNAHPGD
SCHEMBL10207301 0.68 KDM4E (0.36) CES1SRCALDH1A1LMNAHPGD
SCHEMBL8236363 0.68 ALDH1A1 (0.41) CES1ALDH1A1LMNAKDM4EAKT1
SCHEMBL6916221 0.67 CES1 (0.50) CES1SRCALDH1A1LMNAKDM4E
SCHEMBL10956205 0.66 ALDH1A1 (0.49) CES1SRCALDH1A1LMNAHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20010007880-A1 Material based on crosslinked silicone polymer comprising an immobilized photoinitiator, process for the preparation thereof, hydrophilic polymeric product obtained from this material and process for the preparation thereof, and novel photoinitiators ESSILOR INTERNATIONAL COMPAGNIE GENERALE D'OPTIQUE 2001-07-12 US disclosed
US-6197842-B1 CONTACT LENSES ESSILOR INTERNATIONAL COMPAGNIE GENERALE D'OPTIQUE (FR) 2001-03-06 US disclosed