SCHEMBL7560765

SCHEMBL7560765

C=CCC1(C(=O)c2ccccc2)C=CC=CC1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKT1 P31749 1/20 0.35
ALDH1A1 P00352 3/20 0.34
POLB P06746 2/20 0.34
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
LMNA P02545 4/20 0.33
HPGD P15428 2/20 0.33
TSHR P16473 2/20 0.32
CYP2C19 P33261 1/20 0.30
CA2 P00918 2/20 0.30
KDM4E B2RXH2 2/20 0.30
MAPT P10636 2/20 0.30
CA12 O43570 1/20 0.30
CA1 P00915 1/20 0.30
CA9 Q16790 1/20 0.30
CYP3A4 P08684 1/20 0.30
ALOX15 P16050 1/20 0.30
CES1 P23141 1/20 0.30
MAPK1 P28482 1/20 0.30
SMN1; SMN2 Q16637 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
SCHEMBL17180882 0.82 CA1 (0.35) ALDH1A1MEN1KMT2ALMNAHPGD
SCHEMBL28158992 0.80
SCHEMBL8632534 0.75
SCHEMBL6510307 0.75 ALPI (0.37)
SCHEMBL30284985 0.75 ALDH1A1 (0.41) ALDH1A1MEN1KMT2ALMNAHPGD
SCHEMBL30284950 0.74 ALDH1A1 (0.43) ALDH1A1POLBKMT2AHPGDKDM4E
SCHEMBL14760424 0.72 AKT1 (0.40) AKT1ALDH1A1LMNACA2MAPK1
SCHEMBL8344242 0.72 LMNA (0.37) AKT1ALDH1A1POLBMEN1KMT2A
SCHEMBL27981573 0.72 LMNA (0.40) ALDH1A1POLBMEN1KMT2ALMNA
SCHEMBL534047 0.70 LMNA (0.38) ALDH1A1POLBMEN1KMT2ALMNA

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-0907684-B1 CROSS-LINKED SILICONE BASED MATERIAL COMPRISING A BOUND PHOTOINITIATOR, ITS METHOD OF PREPARATION, HYDROPHILIC POLYMERIC PRODUCT OBTAINED FROM THIS MATERIAL AND ITS METHOD OF PREPARATION, AND NOVEL PHOTOINITIATORS ESSILOR INT (FR) 2002-03-27 EP disclosed