SCHEMBL2702145

SCHEMBL2702145

CCOC(=O)[C@]1(C)CC[C@@H](C(C)C)CC1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
PRMT1 Q99873 1/20 0.34
HCRTR2 O43614 1/20 0.33
CES2 O00748 2/20 0.33
CES1 P23141 2/20 0.33
F10 P00742 2/20 0.33
TRPM8 Q7Z2W7 1/20 0.33
POLB P06746 1/20 0.33
TSHR P16473 1/20 0.32
OPRM1 P35372 3/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
OPRD1 P41143 2/20 0.31
OPRK1 P41145 2/20 0.31
SLC22A1 O15245 1/20 0.31
SLC6A4 P31645 1/20 0.31
ADRA1A P35348 1/20 0.31
KCNH2 Q12809 1/20 0.31
ALDH1A1 P00352 1/20 0.31
ATM Q13315 1/20 0.31

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
SCHEMBL2700331 1.00 BRD4 (0.35) BRD4L3MBTL1PRMT1HCRTR2CES2
SCHEMBL1468125 1.00 BRD4 (0.35) BRD4L3MBTL1PRMT1HCRTR2CES2
SCHEMBL2289941 0.81
SCHEMBL18082673 0.80 KDM4E (0.40) BRD4L3MBTL1PRMT1CES2CES1
SCHEMBL2700864 0.80 FFAR3 (0.33) SMN1; SMN2MAPT
SCHEMBL663885 0.80 BRD4 (0.38) BRD4PRMT1CES2CES1F10
SCHEMBL1908605 0.80 KDM4E (0.40) BRD4L3MBTL1PRMT1CES2CES1
SCHEMBL12549788 0.80 BRD4 (0.38) BRD4PRMT1CES2CES1F10
SCHEMBL1468235 0.80 FFAR3 (0.33) SMN1; SMN2MAPT
SCHEMBL2701515 0.80 FFAR3 (0.33) SMN1; SMN2MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2450333-B1 METHOD FOR PRODUCING ALICYCLIC ALCOHOL MITSUBISHI GAS CHEMICAL CO (JP) 2017-07-26 EP disclosed
US-8816136-B2 Method for producing alicyclic alcohol MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2014-08-26 US disclosed
US-8816136-B2 Method for producing alicyclic alcohol MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2014-08-26 US disclosed
US-8816136-B2 Method for producing alicyclic alcohol MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2014-08-26 US disclosed
US-20120238784-A1 METHOD FOR PRODUCING ALICYCLIC ALCOHOL MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2012-09-20 US disclosed
US-20120238784-A1 METHOD FOR PRODUCING ALICYCLIC ALCOHOL MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2012-09-20 US disclosed
EP-2450333-A1 METHOD FOR PRODUCING ALICYCLIC ALCOHOL Mitsubishi Gas Chemical Company, Inc. (JP) 2012-05-09 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 (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-20120238784-A1 METHOD FOR PRODUCING ALICYCLIC ALCOHOL ADH1C, ADH1A, ADH5 BRD4 893/4885L3MBTL1 1549/4885PRMT1 1921/4885

“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.