SCHEMBL2736409

SCHEMBL2736409

CCC(C)(CC(CC(C)(C)C(=O)O)c1ccc(O)cc1)C(=O)OC(C)(C)C

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 2/20 0.35
HSD17B10 Q99714 2/20 0.35
CTSS P25774 1/20 0.35
CTSK P43235 1/20 0.35
ESR1 P03372 7/20 0.34
ESR2 Q92731 5/20 0.34
BLM P54132 1/20 0.33
LMNA P02545 2/20 0.32
CHRM2 P08172 2/20 0.32
CHRM1 P11229 2/20 0.32
CYP1A2 P05177 1/20 0.32
PGR P06401 1/20 0.32
CYP3A4 P08684 1/20 0.32
ADORA3 P0DMS8 1/20 0.32
AR P10275 1/20 0.32
CYP2D6 P10635 1/20 0.32
MAPT P10636 1/20 0.32
ALOX15 P16050 1/20 0.32
DRD1 P21728 1/20 0.32
TBXA2R P21731 1/20 0.32

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
SCHEMBL26374247 0.82 ESR1 (0.35) HSD17B10CTSKESR1LMNAMAPT
SCHEMBL12578602 0.81 ESR1 (0.39) CYP2C9CTSSCTSKESR1ESR2
SCHEMBL14996179 0.79 ESR1 (0.50) CYP2C9HSD17B10ESR1ESR2BLM
SCHEMBL26374273 0.79 LMNA (0.36) ESR1ESR2LMNACHRM2
SCHEMBL2736411 0.78 ESR1 (0.46) CYP2C9HSD17B10ESR1ESR2LMNA
SCHEMBL2736419 0.77 TACR1 (0.37) CYP2C9HSD17B10ESR1CHRM2CHRM1
SCHEMBL2736400 0.76 EPHX1 (0.34) TDP1
SCHEMBL2736410 0.73 ESR1 (0.36) ESR1ESR2CHRM2CHRM1SLC6A2
SCHEMBL15979584 0.72 ESR1 (0.40) HSD17B10CTSKESR1ESR2LMNA
SCHEMBL15957862 0.72 HDAC8 (0.44) CYP2C9HSD17B10ESR1ESR2CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9146467-B2 Coating compositions MERCK PATENT GMBH (DE) 2015-09-29 US disclosed
US-9146467-B2 Coating compositions MERCK PATENT GMBH (DE) 2015-09-29 US disclosed
US-20130236833-A1 COATING COMPOSITIONS AZ ELECTRONIC MATERIALS USA CORP. (US) 2013-09-12 US disclosed
US-20130236833-A1 COATING COMPOSITIONS AZ ELECTRONIC MATERIALS USA CORP. (US) 2013-09-12 US disclosed
US-8455176-B2 Coating composition AZ ELECTRONIC MATERIALS USA CORP. (US) 2013-06-04 US disclosed
US-8088548-B2 Bottom antireflective coating compositions AZ ELECTRONIC MATERIALS USA CORP. (US) 2012-01-03 US disclosed
US-8039202-B2 copolymer containing monomers selected from acrylic acid, methacrylic acid, vinyl alcohol, hydroxystyrenes, acrylic ester of chromophore group or 1,1,1,3,3,3-hexafluoro-2-propanol group; vinyl ether terminated crosslinking agent; solvent resistant, impervious to interdiffusion of photoresist AZ ELECTRONIC MATERIALS USA CORP. (US) 2011-10-18 US disclosed
US-7824837-B2 Positive-working photoimageable bottom antireflective coating AZ ELECTRONIC MATERIALS USA CORP. (US) 2010-11-02 US disclosed
US-20100119972-A1 COATING COMPOSITION MERCK PATENT GMBH (DE) 2010-05-13 US disclosed
US-20090104559-A1 Bottom Antireflective Coating Compositions MERCK PATENT GMBH (DE) 2009-04-23 US disclosed
US-20080090184-A1 Positive -Working Photoimageable Bottom Antireflective Coating MERCK PATENT GMBH (DE) 2008-04-17 US disclosed
US-20080038666-A1 Positive-Working Photoimageable Bottom Antireflective Coating MERCK PATENT GMBH (DE) 2008-02-14 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090104559-A1 Bottom Antireflective Coating Compositions SDC2, S100A9, MYH9 CYP2C9 4450/4885HSD17B10 4444/4885CTSS 3276/4885
US-20100119972-A1 COATING COMPOSITION S100A9, CAPG, C5 CYP2C9 3201/4885HSD17B10 3969/4885CTSS 2972/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.