SCHEMBL16412926

SCHEMBL16412926

C=C(C)C1CCC(C)CC1OC(=O)[C@H](C)O

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 3/20 0.36
TRPM8 Q7Z2W7 1/20 0.36
MAPT P10636 3/20 0.33
ALDH1A1 P00352 2/20 0.33
HPGD P15428 2/20 0.33
CYP19A1 P11511 2/20 0.33
CES2 O00748 1/20 0.31
TSHR P16473 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
KDM4E B2RXH2 1/20 0.30
GAA P10253 1/20 0.30
MAPK1 P28482 1/20 0.30

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
SCHEMBL16412923 1.00 EPHX1 (0.36) EPHX1TRPM8MAPTALDH1A1HPGD
SCHEMBL14742726 1.00 EPHX1 (0.36) EPHX1TRPM8MAPTALDH1A1HPGD
SCHEMBL560313 0.82 CHRM2 (0.38) EPHX1CES2TSHR
SCHEMBL12604928 0.82 EPHX1 (0.37) EPHX1TRPM8ALDH1A1HPGDCYP19A1
SCHEMBL560314 0.82 CHRM2 (0.38) EPHX1CES2TSHR
SCHEMBL16412379 0.81 CYP19A1 (0.41) EPHX1TRPM8MAPTALDH1A1HPGD
SCHEMBL14742826 0.81 CYP19A1 (0.41) EPHX1TRPM8MAPTALDH1A1HPGD
SCHEMBL25990013 0.78 TRPM8 (0.39) EPHX1TRPM8MAPTALDH1A1CYP19A1
SCHEMBL12604937 0.78 EPHX1 (0.54) EPHX1TRPM8MAPTALDH1A1HPGD
SCHEMBL23196361 0.78 EPHX1 (0.57) EPHX1TRPM8MAPTALDH1A1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11528933-B2 Smoking article NICO VENTURES TRADING LIMITED (GB) 2022-12-20 US disclosed
EP-3262955-A2 NOVEL SUBSTITUTED CYCLOHEXANE COMPOUNDS Takasago International Corporation (USA) (US) 2018-01-03 EP disclosed
US-9802885-B2 Substituted cyclohexane compounds TAKASAGO INTERNATIONAL CORPORATION (USA) (US) 2017-10-31 US disclosed
US-20150030744-A1 NOVEL SUBSTITUTED CYCLOHEXANE COMPOUNDS TAKASAGO INTERNATIONAL CORP. (USA) (US) 2015-01-29 US 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-20150030744-A1 NOVEL SUBSTITUTED CYCLOHEXANE COMPOUNDS TAS2R1, TAS2R8, TAS2R13 EPHX1 2170/4885TRPM8 435/4885MAPT 4215/4885

“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.