SCHEMBL10099666

SCHEMBL10099666

CC#Cc1ccc(OC(=O)C2CC3C=CC2C3)cc1

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.43
HPGD P15428 1/20 0.43
KDM4E B2RXH2 2/20 0.38
LMNA P02545 1/20 0.38
POLB P06746 3/20 0.38
KMT2A Q03164 2/20 0.38
RAB9A P51151 1/20 0.37
APEX1 P27695 1/20 0.36
RECQL P46063 1/20 0.36
BLM P54132 1/20 0.36
ESR2 Q92731 1/20 0.36
HSD17B10 Q99714 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
ESR1 P03372 1/20 0.35
THRB P10828 1/20 0.34
HAO1 Q9UJM8 1/20 0.34
ALOX15 P16050 1/20 0.33
MAPK1 P28482 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
SCHEMBL13888468 0.82 ALDH1A1 (0.44) ALDH1A1HPGDKDM4ELMNAPOLB
SCHEMBL10099684 0.82 ALDH1A1 (0.47) ALDH1A1HPGDKDM4ELMNAPOLB
SCHEMBL11348296 0.79 ALDH1A1 (0.44) ALDH1A1HPGDKDM4ELMNAPOLB
SCHEMBL11339493 0.79 LMNA (0.46) ALDH1A1HPGDKDM4ELMNAPOLB
SCHEMBL201849 0.79 ALDH1A1 (0.51) ALDH1A1HPGDKDM4ELMNAPOLB
SCHEMBL9448477 0.78 ALDH1A1 (0.45) ALDH1A1HPGDKDM4ELMNAPOLB
SCHEMBL17843609 0.77 ALDH1A1 (0.44) ALDH1A1HPGDKDM4ELMNAPOLB
SCHEMBL4107319 0.77 KMT2A (0.47) ALDH1A1HPGDKDM4ELMNAPOLB
SCHEMBL13888475 0.76 ALDH1A1 (0.46) ALDH1A1HPGDKDM4ELMNAPOLB
SCHEMBL2139392 0.76 LMNA (0.42) ALDH1A1HPGDKDM4ELMNAPOLB

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-8207365-B2 Polymeric salen compounds and methods thereof GEORGIA TECH RESEARCH CORPORATION (US) 2012-06-26 US disclosed