SCHEMBL15727372

SCHEMBL15727372

Oc1c(-c2ccccc2)cccc1C1CC2CCC1C2

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.41
POLB P06746 1/20 0.41
GAA P10253 1/20 0.41
KMT2A Q03164 1/20 0.41
HNF4A P41235 1/20 0.38
SLC6A3 Q01959 1/20 0.38
HDAC4 P56524 1/20 0.38
HDAC2 Q92769 1/20 0.38
HDAC8 Q9BY41 1/20 0.38
HDAC6 Q9UBN7 1/20 0.38
CHRNB2 P17787 1/20 0.36
CHRNA4 P43681 1/20 0.36
PTPN5 P54829 4/20 0.36
L3MBTL1 Q9Y468 1/20 0.35
PTPN2 P17706 1/20 0.35
KDM4E B2RXH2 1/20 0.35
HTT P42858 1/20 0.35
HPGD P15428 3/20 0.34
ALDH1A1 P00352 1/20 0.34
BCL2L1 Q07817 1/20 0.34

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
SCHEMBL15727373 0.93 HNF4A (0.39) MEN1POLBGAAKMT2AHNF4A
SCHEMBL15727369 0.84 MEN1 (0.43) MEN1POLBGAAKMT2ASLC6A3
SCHEMBL15727354 0.82 MEN1 (0.48) MEN1POLBGAAKMT2ASLC6A3
SCHEMBL19419198 0.82 MEN1 (0.41) MEN1POLBGAAKMT2ASLC6A3
SCHEMBL9467530 0.77 MEN1 (0.47) MEN1POLBGAAKMT2ASLC6A3
SCHEMBL15727363 0.77 MEN1 (0.40) MEN1POLBGAAKMT2ASLC6A3
SCHEMBL26157714 0.75 FABP3 (0.36) MEN1POLBGAAKMT2ASLC6A3
SCHEMBL31634569 0.75 HTR2C (0.38) MEN1POLBGAAKMT2ASLC6A3
SCHEMBL27392603 0.75 HTR2C (0.38) MEN1POLBGAAKMT2ASLC6A3
SCHEMBL15727361 0.74 MEN1 (0.39) MEN1POLBGAAKMT2ASLC6A3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170282169-A1 ALUMINUM CATALYST TAKASAGO INTERNATIONAL CORPORATION (JP) 2017-10-05 US disclosed
US-20170282169-A1 ALUMINUM CATALYST TAKASAGO INTERNATIONAL CORPORATION (JP) 2017-10-05 US disclosed
US-20150329452-A1 METHOD FOR PRODUCING OPTICALLY ACTIVE ISOPULEGOL AND OPTICALLY ACTIVE MENTHOL TAKASAGO INTERNATIONAL CORPORATION (JP) 2015-11-19 US disclosed
US-20150329452-A1 METHOD FOR PRODUCING OPTICALLY ACTIVE ISOPULEGOL AND OPTICALLY ACTIVE MENTHOL TAKASAGO INTERNATIONAL CORPORATION (JP) 2015-11-19 US disclosed
US-20150315110-A1 ALUMINUM CATALYST TAKASAGO INTERNATIONAL CORPORATION (JP) 2015-11-05 US disclosed
US-20150315110-A1 ALUMINUM CATALYST TAKASAGO INTERNATIONAL CORPORATION (JP) 2015-11-05 US disclosed
EP-2921229-A1 ALUMINUM CATALYST Takasago International Corporation (JP) 2015-09-23 EP disclosed
EP-2921228-A1 METHOD FOR PRODUCING OPTICALLY ACTIVE ISOPULEGOL AND OPTICALLY ACTIVE MENTHOL Takasago International Corporation (JP) 2015-09-23 EP disclosed
WO-2014077323-A1 METHOD FOR PRODUCING OPTICALLY ACTIVE ISOPULEGOL AND OPTICALLY ACTIVE MENTHOL 高砂香料工業株式会社 (JP) 2014-05-22 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-20150329452-A1 METHOD FOR PRODUCING OPTICALLY ACTIVE ISOPULEGOL AND OPTICALLY ACTIVE MENTHOL ACSL3, ACSL6, ALOX5 MEN1 481/4885POLB 1538/4885GAA 1135/4885
US-20170282169-A1 ALUMINUM CATALYST ACSL6, ACSL3, HACL2 MEN1 1699/4885POLB 1932/4885GAA 1271/4885
US-20150315110-A1 ALUMINUM CATALYST ACSL6, ACSL3, HACL2 MEN1 1699/4885POLB 1932/4885GAA 1271/4885

“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.