SCHEMBL13822668

SCHEMBL13822668

CCCCCC(CC)OC(=O)C1C2CCC(C2)C1C(=O)O

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 3/20 0.41
RAB9A P51151 3/20 0.41
EPHX2 P34913 2/20 0.39
PRKCA P17252 1/20 0.37
PRKCD Q05655 1/20 0.37
ALDH1A1 P00352 5/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
TAAR1 Q96RJ0 1/20 0.34
HTT P42858 1/20 0.34
CNR1 P21554 1/20 0.34
DAGLA Q9Y4D2 1/20 0.34
ACE2 Q9BYF1 1/20 0.33
KMT2A Q03164 1/20 0.33
GPR84 Q9NQS5 3/20 0.33
FFAR1 O14842 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
SCHEMBL13518198 0.88 EPHX2 (0.39) EPHX2PRKCAPRKCDALDH1A1CNR1
SCHEMBL13822647 0.83 EPHX2 (0.34) EPHX2PRKCAPRKCD
SCHEMBL13822595 0.82 EPHX2 (0.35) EPHX2PRKCAPRKCDCNR1DAGLA
SCHEMBL13822572 0.81 EPHX2 (0.36) EPHX2PRKCAPRKCDCNR1DAGLA
SCHEMBL13822570 0.81 POLB (0.47) RAB9AEPHX2PRKCAPRKCDALDH1A1
SCHEMBL30272012 0.81 EPHX2 (0.47) EPHX2PRKCAPRKCDCNR1DAGLA
SCHEMBL13822458 0.80 EPHX2 (0.35) EPHX2PRKCAPRKCDCNR1DAGLA
SCHEMBL13822509 0.80 EPHX2 (0.38) EPHX2PRKCAPRKCDCNR1DAGLA
SCHEMBL13822551 0.75 PRKCA (0.34) EPHX2PRKCAPRKCDCNR1DAGLA
SCHEMBL7719860 0.75 EPHX2 (0.39) EPHX2PRKCAPRKCDCNR1DAGLA

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-10308563-B2 Process for producing ethylene oligomers HANWHA TOTAL PETROCHEMICAL CO., LTD. (KR) 2019-06-04 US disclosed
EP-2524930-B1 PREPARATION METHOD OF SOLID CATALYST FOR PROPYLENE POLYMERIZATION, AND CATALYST PREPARED THEREBY HANWHA TOTAL PETROCHEMICAL CO LTD (KR) 2018-09-12 EP disclosed
US-20180170827-A1 PROCESS FOR PRODUCING ETHYLENE OLIGOMERS HANWHA TOTALENERGIES PETROCHEMICAL CO., LTD. (KR) 2018-06-21 US disclosed
US-20180169642-A1 CATALYST SYSTEM FOR ETHYLENE OLIGOMERIZATION AND METHOD FOR PRODUCING ETHYLENE OLIGOMERIZATION USING THE SAME HANWHA TOTAL PETROCHEMICAL CO., LTD. (KR) 2018-06-21 US disclosed
US-9045572-B2 Preparation method of solid catalyst for propylene polymerization and catalyst prepared thereby SAMSUNG TOTAL PETROCHEMICALS CO., LTD. (KR) 2015-06-02 US disclosed
US-20140005345-A1 SOLID CATALYST FOR PROPYLENE POLYMERIZATION AND A METHOD FOR PREPARATION OF POLYPROPYLENE HANWHA TOTAL PETROCHEMICAL CO., LTD. (KR) 2014-01-02 US disclosed
US-20130017946-A1 PREPARATION METHOD OF SOLID CATALYST FOR PROPYLENE POLYMERIZATION AND CATALYST PREPARED THEREBY SAMSUNG TOTAL PETROCHEMICALS CO., LTD. (KR) 2013-01-17 US disclosed
EP-2524930-A2 PREPARATION METHOD OF SOLID CATALYST FOR PROPYLENE POLYMERIZATION, AND CATALYST PREPARED THEREBY Samsung Total Petrochemicals Co. Ltd. (KR) 2012-11-21 EP 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 (3 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-10308563-B2 Process for producing ethylene oligomers OXER1, HAO2, ORC3 NPC1 1536/4885RAB9A 3258/4885EPHX2 27/4885
US-20180169642-A1 CATALYST SYSTEM FOR ETHYLENE OLIGOMERIZATION AND METHOD FOR PRODUCING ETHYLENE OLIGOMERIZATION USING THE SAME HACL2, HAO2, MSMO1 NPC1 1894/4885RAB9A 3554/4885EPHX2 17/4885
US-20180170827-A1 PROCESS FOR PRODUCING ETHYLENE OLIGOMERS OXER1, HAO2, ORC3 NPC1 1536/4885RAB9A 3258/4885EPHX2 27/4885

“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.