SCHEMBL15344632

SCHEMBL15344632

CCCOC(=O)c1cccc(CCC)c1

nearest known ligand 0.62

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.62
CYP4F2 P78329 3/20 0.60
CYP4A11 Q02928 3/20 0.60
ALDH1A1 P00352 4/20 0.55
TSHR P16473 2/20 0.51
ESR1 P03372 1/20 0.51
CHRM1 P11229 1/20 0.51
SLC6A2 P23975 1/20 0.51
KDR P35968 1/20 0.51
TDP1 Q9NUW8 1/20 0.51
KDM4E B2RXH2 1/20 0.50
POLB P06746 1/20 0.50
MAPT P10636 2/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
TP53 P04637 1/20 0.49
KMT2A Q03164 1/20 0.49
SLC7A5 Q01650 1/20 0.48
TYR P14679 1/20 0.48
LOXL2 Q9Y4K0 1/20 0.47

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
SCHEMBL15344564 0.91 CYP4F2 (0.61) LMNACYP4F2CYP4A11ALDH1A1TSHR
SCHEMBL3033016 0.90 LMNA (0.66) LMNACYP4F2CYP4A11ALDH1A1TSHR
SCHEMBL7476830 0.89 LMNA (0.57) LMNACYP4F2CYP4A11ALDH1A1TSHR
SCHEMBL12035616 0.89 CYP4F2 (0.75) CYP4F2CYP4A11ALDH1A1TSHRKDM4E
SCHEMBL19350853 0.88 CYP4F2 (0.62) LMNACYP4F2CYP4A11ALDH1A1
SCHEMBL3012847 0.87 LMNA (0.54) LMNACYP4F2CYP4A11ALDH1A1TSHR
SCHEMBL20012766 0.87 CYP4F2 (0.53) LMNACYP4F2CYP4A11ALDH1A1SMN1; SMN2
SCHEMBL29579787 0.87 LMNA (0.54) LMNACYP4F2CYP4A11ALDH1A1TSHR
SCHEMBL13291593 0.86 CYP4F2 (0.62) LMNACYP4F2CYP4A11ALDH1A1TSHR
SCHEMBL111664 0.86 LMNA (0.75) LMNAALDH1A1TSHRESR1CHRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102834420-B Internal and external donor compounds for olefin polymerization catalysts ii BASF CORP. (US) 2014-10-22 CN claimed
US-8569195-B2 Internal and external donor compounds for olefin polymerization catalysts II BASF CORPORATION (US) 2013-10-29 US claimed
CN-102834420-A Internal and external donor compounds for olefin polymerization catalysts ii BASF CORP 2012-12-19 CN claimed
EP-2782938-B1 HIGH ACTIVITY CATALYST FOR OLEFIN POLYMERIZATION BASF CORP (US) 2016-08-31 EP disclosed
CN-102834420-B Internal and external donor compounds for olefin polymerization catalysts ii BASF CORP. (US) 2014-10-22 CN disclosed
CN-102834420-A Internal and external donor compounds for olefin polymerization catalysts ii BASF CORP 2012-12-19 CN disclosed