SCHEMBL5077756

SCHEMBL5077756

CCCCOC(=O)N(C)C(CC)C(=O)O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.42
ATM Q13315 1/20 0.40
HCAR2 Q8TDS4 3/20 0.40
TSHR P16473 3/20 0.38
HPGD P15428 2/20 0.38
MAPK1 P28482 3/20 0.36
CA2 P00918 2/20 0.36
ESR1 P03372 3/20 0.36
NAAA Q02083 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
KDM4E B2RXH2 1/20 0.35
NPC1 O15118 1/20 0.35
MAPT P10636 1/20 0.35
RAB9A P51151 1/20 0.35
MCL1 Q07820 1/20 0.35
DNM1 Q05193 1/20 0.33
CA1 P00915 1/20 0.33
EPHX1 P07099 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
SCHEMBL7375873 0.85 ALDH1A1 (0.39) ALDH1A1ATMHCAR2TSHRHPGD
SCHEMBL8591963 0.84 ALDH1A1 (0.38) ALDH1A1ATMHCAR2TSHRHPGD
SCHEMBL2966900 0.83 TSHR (0.44) ALDH1A1ATMHCAR2TSHRHPGD
SCHEMBL2966906 0.83 TSHR (0.44) ALDH1A1ATMHCAR2TSHRHPGD
SCHEMBL30890666 0.82 ITGB3 (0.38) ALDH1A1ATMHCAR2TSHRHPGD
SCHEMBL18248175 0.82 ALDH1A1 (0.36) ALDH1A1ATMHCAR2TSHRHPGD
SCHEMBL30890639 0.82 ITGB3 (0.38) ALDH1A1ATMHCAR2TSHRHPGD
SCHEMBL4620776 0.81 TSHR (0.49) ALDH1A1ATMHCAR2TSHRHPGD
SCHEMBL3059935 0.81 ALDH1A1 (0.44) ALDH1A1ATMHCAR2TSHRHPGD
SCHEMBL1759122 0.81 ALDH1A1 (0.44) ALDH1A1ATMHCAR2TSHRHPGD

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-8288606-B2 Magnesium, titanium, and halogen; internal electron donor, ethyl N-Boc-sarcosine, ethyl N-propionyl sarcosine, ethyl N-Boc-pipercolinate, N-carbobenzyloxy-L-proline methyl ester; polymerize propylene and ethylene or alpha-olefin; internal modifier which does not contain a phthalate derivative INEOS USA LLC (US) 2012-10-16 US claimed
EP-3541857-A1 CATALYST COMPONENTS FOR THE POLYMERIZATION OF OLEFINS Basell Poliolefine Italia S.r.l. (IT) 2019-09-25 EP disclosed
WO-2018091375-A1 CATALYST COMPONENTS FOR THE POLYMERIZATION OF OLEFINS BASELL POLIOLEFINE ITALIA S.R.L. (IT) 2018-05-24 WO disclosed
EP-1866347-B1 PROPYLENE POLYMER CATALYST DONOR COMPONENT INEOS TECH USA LLC (US) 2018-05-09 EP disclosed
US-8288606-B2 Magnesium, titanium, and halogen; internal electron donor, ethyl N-Boc-sarcosine, ethyl N-propionyl sarcosine, ethyl N-Boc-pipercolinate, N-carbobenzyloxy-L-proline methyl ester; polymerize propylene and ethylene or alpha-olefin; internal modifier which does not contain a phthalate derivative INEOS USA LLC (US) 2012-10-16 US disclosed
US-20080125614-A1 Propylene polymer catalyst donor component INNOVENE USA (US) 2008-05-29 US disclosed
EP-1866347-A2 PROPYLENE POLYMER CATALYST DONOR COMPONENT INEOS USA LLC (US) 2007-12-19 EP disclosed
WO-2006110234-A2 PROPYLENE POLYMER CATALYST DONOR COMPONENT INEOS USA LLC (US) 2006-10-19 WO 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 (1 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-20080125614-A1 Propylene polymer catalyst donor component RAD52, PGR, DRD2 ALDH1A1 4619/4885ATM 1439/4885HCAR2 874/4885

“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.