SCHEMBL6742416

SCHEMBL6742416

CC1=CCCC(C)OCC2OC(=O)C(CN3CCCC3C(=O)O)C2CC1

nearest known ligand 0.41

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TAS2R46 P59540 8/20 0.36
MEN1 O00255 1/20 0.33
MITF O75030 1/20 0.33
KMT2A Q03164 1/20 0.33
ATM Q13315 1/20 0.33
TAS2R31 P59538 2/20 0.30
TAS2R10 Q9NYW0 2/20 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
SCHEMBL6741385 0.83 KMT2A (0.39) TAS2R46MEN1MITFKMT2ATAS2R31
SCHEMBL6745284 0.82 KMT2A (0.40) TAS2R46MEN1MITFKMT2ATAS2R31
SCHEMBL1231563 0.81 TAS2R46 (0.52) TAS2R46MEN1KMT2ATAS2R31TAS2R10
SCHEMBL6741726 0.79 KMT2A (0.41) TAS2R46MEN1MITFKMT2ATAS2R31
SCHEMBL6739764 0.79 TAS2R46 (0.37) TAS2R46MEN1MITFKMT2ATAS2R31
SCHEMBL6742421 0.76 NLRP3 (0.45) MEN1KMT2A
SCHEMBL6742413 0.76 NLRP3 (0.45) MEN1KMT2A
SCHEMBL6741650 0.76 TAS2R46 (0.41) TAS2R46MEN1KMT2ATAS2R31TAS2R10
SCHEMBL6744280 0.74 TAS2R46 (0.39) TAS2R46MEN1KMT2ATAS2R31TAS2R10
SCHEMBL6739772 0.73 TAS2R46 (0.39) TAS2R46TAS2R31TAS2R10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040229936-A1 Treatment of hepatitis C virus infection with sesquiterpene lactones HSIEH HSING-PANG (TW) 2004-11-18 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-20040229936-A1 Treatment of hepatitis C virus infection with sesquiterpene lactones HAVCR2, HCCS, ZC3HAV1 TAS2R46 3891/4885MEN1 4189/4885MITF 4771/4885

“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.