SCHEMBL3859841

SCHEMBL3859841

Cc1ccc(CNC(=O)C2CCC(CN(Cc3cccc(C(F)(F)F)c3)S(=O)(=O)c3ccccc3)CC2)cc1

nearest known ligand 0.58

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TAS2R14 Q9NYV8 9/20 0.58
TP53 P04637 1/20 0.51
RORC P51449 2/20 0.49
KMT2A Q03164 2/20 0.47
NPSR1 Q6W5P4 1/20 0.47
LMNA P02545 1/20 0.46
TSHR P16473 1/20 0.46
STAT3 P40763 1/20 0.46

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
SCHEMBL3850597 0.95 TAS2R14 (0.58) TAS2R14TP53RORCNPSR1LMNA
SCHEMBL3851418 0.92 TAS2R14 (0.61) TAS2R14KMT2ALMNA
SCHEMBL3860348 0.90 TAS2R14 (0.63) TAS2R14TP53KMT2ALMNA
SCHEMBL3853015 0.89 TAS2R14 (0.72) TAS2R14TP53KMT2ALMNA
SCHEMBL3853063 0.87 TAS2R14 (0.76) TAS2R14TP53LMNA
SCHEMBL3858876 0.85 TAS2R14 (0.55) TAS2R14KMT2ATSHRSTAT3
SCHEMBL3856963 0.84 TAS2R14 (0.66) TAS2R14TP53KMT2ALMNA
SCHEMBL3856020 0.84 TAS2R14 (0.55) TAS2R14TP53KMT2ATSHR
SCHEMBL13714179 0.84 TAS2R14 (0.59) TAS2R14TP53KMT2ATSHR
SCHEMBL3856062 0.84 TAS2R14 (0.70) TAS2R14TP53LMNA

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 4736/4885TP53 4391/4885RORC 1561/4885

“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.