SCHEMBL4307405

SCHEMBL4307405

O=C1C(=O)C(c2ccccc2)C1O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EDNRA P25101 2/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
MAPT P10636 4/20 0.43
LMNA P02545 1/20 0.43
TP53 P04637 1/20 0.43
CYP1A2 P05177 1/20 0.43
CYP3A4 P08684 1/20 0.43
MAPK1 P28482 1/20 0.43
HTR2B P41595 1/20 0.43
KDM4E B2RXH2 2/20 0.37
POLB P06746 2/20 0.37
ESR1 P03372 2/20 0.37
ESR2 Q92731 2/20 0.37
CA2 P00918 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
ALOX15 P16050 2/20 0.36
PARP3 Q9Y6F1 1/20 0.36
USP2 O75604 1/20 0.36
THRB P10828 1/20 0.36

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
SCHEMBL29475772 0.77 CYP2D6 (0.51) EDNRASMN1; SMN2MAPTLMNATP53
SCHEMBL5545415 0.73 ALDH1A1 (0.42) SMN1; SMN2MAPTTP53CYP1A2CYP3A4
SCHEMBL10843954 0.71 SMN1; SMN2 (0.65) EDNRASMN1; SMN2MAPTLMNATP53
SCHEMBL3562486 0.69 ALDH1A1 (0.43) SMN1; SMN2MAPTLMNACYP3A4MAPK1
SCHEMBL9232213 0.67 SMN1; SMN2 (0.39) EDNRASMN1; SMN2MAPTLMNATP53
SCHEMBL24515872 0.67 EDNRA (0.39) EDNRASMN1; SMN2MAPTLMNATP53
SCHEMBL10745108 0.67 EDNRA (0.39) EDNRASMN1; SMN2MAPTLMNATP53
SCHEMBL27532466 0.66 SMN1; SMN2 (0.38) EDNRASMN1; SMN2MAPTLMNATP53
SCHEMBL623142 0.66 EDNRA (0.38) EDNRASMN1; SMN2MAPTLMNATP53
SCHEMBL15968071 0.65 RET (0.42) SMN1; SMN2MAPTLMNATP53CYP1A2

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
US-20090233142-A2 POLYMER HAVING OXOCARBON GROUP, AND USE THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-09-17 US disclosed
US-20070218335-A1 POLYMER HAVING OXOCARBON GROUP, AND USE THEREOF KAO CORPORATION (JP) 2007-09-20 US disclosed
EP-1741740-A1 POLYMER HAVING OXOCARBON GROUP AND USE THEREOF Sumitomo Chemical Company, Limited (JP) 2007-01-10 EP disclosed