SCHEMBL2736402

SCHEMBL2736402

CCC(C)(CC(C)(C)C(=O)OC(C)(C)C)C(=O)Oc1ccc(O)cc1

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ELANE P08246 11/20 0.44
BCHE P06276 1/20 0.37
CHRM2 P08172 1/20 0.37
ALDH1A1 P00352 1/20 0.36
MIF P14174 1/20 0.34
KDM4E B2RXH2 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
ESR1 P03372 1/20 0.33
ESR2 Q92731 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
SCHEMBL26499165 0.91 ELANE (0.49) ELANEBCHECHRM2ALDH1A1KDM4E
SCHEMBL20100796 0.88 ELANE (0.47) ELANEBCHECHRM2ALDH1A1KDM4E
SCHEMBL26498989 0.88 ELANE (0.47) ELANEBCHECHRM2ALDH1A1KDM4E
SCHEMBL26499177 0.88 ELANE (0.47) ELANEBCHECHRM2ALDH1A1KDM4E
SCHEMBL16200777 0.88 ELANE (0.47) ELANEBCHECHRM2ALDH1A1KDM4E
SCHEMBL16865916 0.88 ELANE (0.47) ELANEBCHECHRM2ALDH1A1KDM4E
SCHEMBL12714502 0.86 ELANE (0.50) ELANEBCHECHRM2ALDH1A1MIF
SCHEMBL2736415 0.86 LMNA (0.39) ELANEMEN1KMT2A
SCHEMBL26080959 0.83 ESR1 (0.39) ELANEBCHECHRM2ALDH1A1ESR1
SCHEMBL27047327 0.83 ESR1 (0.39) ELANEBCHECHRM2ALDH1A1ESR1

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 8 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-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

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 ELANE 3373/4885BCHE 1358/4885CHRM2 1401/4885
US-20100119972-A1 COATING COMPOSITION S100A9, CAPG, C5 ELANE 2119/4885BCHE 824/4885CHRM2 1420/4885

“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.