SCHEMBL5065272

SCHEMBL5065272

C=C(C)C(=O)Oc1c(O)ccc(C(=O)c2ccccc2)c1OCCC

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ELANE P08246 1/20 0.47
CCNB2 O95067 2/20 0.44
CCNE2 O96020 2/20 0.44
CDK1 P06493 2/20 0.44
CCNB1 P14635 2/20 0.44
CCNE1 P24864 2/20 0.44
CDK2 P24941 2/20 0.44
CCNB3 Q8WWL7 2/20 0.44
HPGD P15428 5/20 0.39
MAPT P10636 8/20 0.39
LMNA P02545 5/20 0.39
HTT P42858 2/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
ALDH1A1 P00352 4/20 0.38
MAPK1 P28482 3/20 0.38
CYP1A2 P05177 1/20 0.38
PGR P06401 1/20 0.38
CYP2D6 P10635 1/20 0.38
SLC6A2 P23975 1/20 0.38

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
SCHEMBL11499163 0.83 MAPT (0.46) ELANECCNB2CCNE2CDK1CCNB1
SCHEMBL6928775 0.80 ELANE (0.56) ELANEHPGDMAPTLMNAHTT
SCHEMBL28495783 0.80 CCNB2 (0.51) CCNB2CCNE2CDK1CCNB1CCNE1
SCHEMBL1415831 0.75 TDP1 (0.46) ELANECCNB2CCNE2CDK1CCNB1
SCHEMBL10758904 0.75 MAPT (0.48) CCNB2CCNE2CDK1CCNB1CCNE1
SCHEMBL3183095 0.74 MAPT (0.49) ELANEHPGDMAPTLMNAHTT
SCHEMBL27666465 0.74 CCNB2 (0.43) ELANECCNB2CCNE2CDK1CCNB1
SCHEMBL10662113 0.73 ELANE (0.57) ELANEHPGDMAPTLMNAALDH1A1
SCHEMBL28048336 0.73 CCNB2 (0.46) CCNB2CCNE2CDK1CCNB1CCNE1
SCHEMBL28705111 0.72 MAPT (0.47) CCNB2CCNE2CDK1CCNB1CCNE1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3187517-A1 PHOSPHOROUS-CONTAINING ORGANIC POLYMER AND COMPOSITIONS AND PROCESSESS INCLUDING THE SAME ROHM AND HAAS COMPANY (US) 2017-07-05 EP disclosed
US-8877852-B2 Phosphorous-containing organic polymer and compositions and processes including same ROHM AND HAAS COMPANY (US) 2014-11-04 US disclosed
US-20080146724-A1 coatings comprising anionic polymers as dispersants for inorganic nanoparticles ROHM AND HAAS COMPANY 2008-06-19 US disclosed
EP-1932862-A1 Phosphorous-containing organic polymer and compositions and processes including same Rohm and Haas Company (US) 2008-06-18 EP disclosed