SCHEMBL6677245

SCHEMBL6677245

COC1(OC)CCC(O)CC1

nearest known ligand 0.33

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TSHR P16473 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
SCHEMBL31715625 0.80
SCHEMBL14720624 0.76 TSHR (0.32) TSHR
SCHEMBL25460716 0.76 TSHR (0.32) TSHR
SCHEMBL27575047 0.76 TSHR (0.32) TSHR
SCHEMBL7220261 0.74
SCHEMBL7220256 0.72
SCHEMBL15866148 0.72 SHBG (0.33)
SCHEMBL2931908 0.72 APLNR (0.32)
SCHEMBL6676256 0.71
SCHEMBL31167979 0.71

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180093990-A1 HYDROPHOBICALLY TAGGED SMALL MOLECULES AS INDUCERS OF PROTEIN DEGRADATION DANA-FARBER CANCER INSTITUTE, INC. (US) 2018-04-05 US disclosed
US-8314254-B2 Substituted spirocyclic ketoenols BAYER CROPSCIENCE AG (DE) 2012-11-20 US disclosed
US-8314254-B2 Substituted spirocyclic ketoenols BAYER CROPSCIENCE AG (DE) 2012-11-20 US disclosed
EP-2233466-A1 4-Alkoxy-1-amino-1-cyclohexanecarboxylic acid derivatives and their use as intermediates Bayer CropScience AG (DE) 2010-09-29 EP disclosed
US-20100234229-A1 Substituted Spirocyclic Ketoenols BAYER INTELLECTUAL PROPERTY GMBH (DE) 2010-09-16 US disclosed
US-20100234229-A1 Substituted Spirocyclic Ketoenols BAYER INTELLECTUAL PROPERTY GMBH (DE) 2010-09-16 US disclosed
US-7754654-B2 Substituted spirocyclic ketoenols BAYER CROPSCIENCE AG (DE) 2010-07-13 US disclosed
US-20070275858-A1 SUBSTITUTED SPIROCYCLIC KETOENOLS BAYER CROPSCIENCE AG (DE) 2007-11-29 US disclosed
US-7211694-B2 Substituted 4-aminocyclohexanols GRUENENTHAL GMBH (DE) 2007-05-01 US disclosed
WO-2004046072-A1 METHOD FOR PRODUCING 1,6-HEXANEDIOL WITH A PURITY OF GREATER THAN 99.5 % BASF AKTIENGESELLSCHAFT (DE) 2004-06-03 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-20070275858-A1 SUBSTITUTED SPIROCYCLIC KETOENOLS PDHX, CYP19A1, AKR1A1 TSHR 2437/4885
US-20100234229-A1 Substituted Spirocyclic Ketoenols HSD17B7, CYP17A1, HSD17B11 TSHR 2742/4885
US-20180093990-A1 HYDROPHOBICALLY TAGGED SMALL MOLECULES AS INDUCERS OF PROTEIN DEGRADATION MYC, TP53, MDM2 TSHR 2182/4885

“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.