SCHEMBL3860084

SCHEMBL3860084

Cc1ccc(C(C(N)=O)C2CCC(CN(Cc3ccccc3)S(=O)(=O)c3cccc(Cl)c3)CC2)cc1

nearest known ligand 0.55

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TAS2R14 Q9NYV8 11/20 0.55
LMNA P02545 2/20 0.49
POLB P06746 1/20 0.45
CTSL P07711 1/20 0.45
CTSS P25774 1/20 0.45
TP53 P04637 1/20 0.45
CNR2 P34972 1/20 0.44
MAPK1 P28482 1/20 0.42
KCNA5 P22460 1/20 0.42
THRB P10828 1/20 0.41

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
SCHEMBL3859825 0.93 TAS2R14 (0.56) TAS2R14LMNAPOLBTP53CNR2
SCHEMBL3853116 0.91 TAS2R14 (0.62) TAS2R14LMNAPOLBTP53CNR2
SCHEMBL3849137 0.90 TAS2R14 (0.55) TAS2R14LMNATP53CNR2MAPK1
SCHEMBL3850260 0.90 TAS2R14 (0.57) TAS2R14LMNATP53CNR2MAPK1
SCHEMBL3853648 0.90 TAS2R14 (0.57) TAS2R14LMNATP53CNR2MAPK1
SCHEMBL3855851 0.89 TAS2R14 (0.54) TAS2R14LMNAPOLBTP53CNR2
SCHEMBL3855993 0.89 TAS2R14 (0.59) TAS2R14LMNAPOLBTP53CNR2
SCHEMBL3856045 0.88 TAS2R14 (0.61) TAS2R14LMNATP53MAPK1KCNA5
SCHEMBL3852854 0.88 TAS2R14 (0.57) TAS2R14LMNATP53CNR2MAPK1
SCHEMBL3856017 0.87 TAS2R14 (0.49) TAS2R14LMNAPOLBTP53CNR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7579504-B2 ABCA1 elevating compounds GILEAD SCIENCES, INC. (US) 2009-08-25 US claimed
US-20070203245-A1 ABCA1 elevating compounds CV THERAPEUTICS, INC. 2007-08-30 US claimed
US-7579504-B2 ABCA1 elevating compounds GILEAD SCIENCES, INC. (US) 2009-08-25 US disclosed
US-20070203245-A1 ABCA1 elevating compounds CV THERAPEUTICS, INC. 2007-08-30 US disclosed
WO-2007067817-A1 ABCA1 ELEVATING COMPOUNDS CV THERAPEUTICS, INC. (US) 2007-06-14 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 (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-20070203245-A1 ABCA1 elevating compounds ABCD3, ABCB4, CETP TAS2R14 4736/4885LMNA 830/4885POLB 2998/4885

“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.