SCHEMBL789154

SCHEMBL789154

OOc1cccc(C2CCCCC2)c1

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KMO O15229 1/20 0.53
HDAC4 P56524 1/20 0.50
HDAC2 Q92769 1/20 0.50
HDAC8 Q9BY41 1/20 0.50
HTR2C P28335 2/20 0.47
SPHK1 Q9NYA1 1/20 0.45
PRMT5 O14744 1/20 0.43
WDR77 Q9BQA1 1/20 0.43
CYP11B2 P19099 1/20 0.42
DRD2 P14416 2/20 0.41
ACMSD Q8TDX5 1/20 0.40
HAO1 Q9UJM8 1/20 0.40
CETP P11597 1/20 0.39
GRM2 Q14416 1/20 0.39
NAAA Q02083 1/20 0.39

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
Hydrogen Peroxide SCHEMBL11391460 0.82 KMO (0.71) KMOHDAC4HDAC2HDAC8HTR2C
SCHEMBL669730 0.82 KMO (0.64) KMOHDAC4HDAC2HDAC8HTR2C
SCHEMBL5667650 0.82 KMO (0.64) KMOHDAC4HDAC2HDAC8HTR2C
SCHEMBL9391575 0.81 CETP (0.50) KMOHDAC4HDAC2HDAC8HTR2C
SCHEMBL2095198 0.81 HTR2C (0.70) KMOHTR2CDRD2
SCHEMBL2095197 0.81 KMO (0.49) KMOHDAC4HDAC2HDAC8HTR2C
SCHEMBL28313902 0.81 KMO (0.49) KMOHDAC4HDAC2HDAC8HTR2C
SCHEMBL23673286 0.80 KMO (0.47) KMOHDAC4HDAC2HDAC8HTR2C
SCHEMBL31012118 0.80 KMO (0.47) KMOHDAC4HDAC2HDAC8HTR2C
SCHEMBL5666805 0.80 KMO (0.62) KMOHDAC4HDAC2HDAC8HTR2C

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 116 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2616435-A1 CYCLOHEXYLBENZENE HYDROPEROXIDE COMPOSITIONS Exxonmobil Chemical Patents Inc. A Corporation Of The State Of Delaware (US) 2013-07-24 EP claimed
WO-2012036820-A1 CYCLOHEXYLBENZENE HYDROPEROXIDE COMPOSITIONS EXXONMOBIL CHEMICAL PATENTS INC. (US) 2012-03-22 WO claimed
CN-105102119-B process for preparing alkylated aromatic compounds 埃克森美孚化学专利公司 2019-12-06 CN disclosed
EP-3180304-B1 PROCESS FOR PRODUCING CYCLOHEXANONE EXXONMOBIL CHEMICAL PATENTS INC (US) 2019-10-30 EP disclosed
US-10286334-B2 Process for removing water and/or oxygen from organic liquid EXXONMOBIL CHEMICAL PATENTS INC. (US) 2019-05-14 US disclosed
US-10259759-B2 Cyclohexylbenzene composition EXXONMOBIL CHEMICAL PATENTS INC. (US) 2019-04-16 US disclosed
EP-3071540-B1 PROCESS FOR MAKING PHENOL AND/OR CYCLOHEXANONE EXXONMOBIL CHEMICAL PATENTS INC (US) 2019-04-03 EP disclosed
US-10233140-B2 Process for making cyclohexanone EXXONMOBIL CHEMICAL PATENTS INC. (US) 2019-03-19 US disclosed
EP-3180302-B1 PROCESS FOR PRODUCING CYCLOHEXANONE EXXONMOBIL CHEMICAL PATENTS INC (US) 2019-01-30 EP disclosed
EP-3180303-B1 PROCESS AND SYSTEM FOR MAKING CYCLOHEXANONE EXXONMOBIL CHEMICAL PATENTS INC (US) 2018-07-18 EP disclosed
EP-2964354-B1 SYSTEM AND PROCESS FOR MAKING PHENOL AND/OR CYCLOHEXANONE EXXONMOBIL CHEMICAL PATENTS INC (US) 2018-05-30 EP disclosed
CN-104030891-A SYSTEM AND PROCESS FOR MAKING PHENOL AND/OR CYCLOHEXANONE EXXONMOBIL CHEM PATENTS INC 2014-09-10 CN disclosed
EP-2616426-A1 CYCLOHEXANONE COMPOSITIONS ExxonMobil Chemical Patents Inc. (US) 2013-07-24 EP disclosed
EP-2616435-A1 CYCLOHEXYLBENZENE HYDROPEROXIDE COMPOSITIONS Exxonmobil Chemical Patents Inc. A Corporation Of The State Of Delaware (US) 2013-07-24 EP disclosed
EP-2616420-A1 PHENOL COMPOSITIONS ExxonMobil Chemical Patents Inc. (US) 2013-07-24 EP disclosed
WO-2013052216-A1 PROCESS FOR PRODUCING PHENOL FROM CYCLOHEXYLBENZENE HYDROPEROXIDE EXXONMOBIL CHEMICAL PATENTS INC. (US) 2013-04-11 WO disclosed
WO-2012036822-A1 PHENOL AND CYCLOHEXANONE MIXTURES EXXONMOBIL CHEMICAL PATENTS INC. (US) 2012-03-22 WO disclosed
WO-2012036820-A1 CYCLOHEXYLBENZENE HYDROPEROXIDE COMPOSITIONS EXXONMOBIL CHEMICAL PATENTS INC. (US) 2012-03-22 WO disclosed
WO-2012036821-A1 PHENOL COMPOSITIONS EXXONMOBIL CHEMICAL PATENTS INC. (US) 2012-03-22 WO disclosed
WO-2012036818-A1 CYCLOHEXANONE COMPOSITIONS EXXONMOBIL CHEMICAL PATENTS INC. (US) 2012-03-22 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 (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-10259759-B2 Cyclohexylbenzene composition CYP1B1, CYP4B1, MCCC2 KMO 93/4885HDAC4 1709/4885HDAC2 1584/4885
US-10286334-B2 Process for removing water and/or oxygen from organic liquid SORD, DUOX2, DCXR KMO 472/4885HDAC4 4696/4885HDAC2 3441/4885
US-10233140-B2 Process for making cyclohexanone HPD, KHK, CHKB KMO 86/4885HDAC4 2549/4885HDAC2 1238/4885

“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.