SCHEMBL3856885

SCHEMBL3856885

Cc1ccc(CN(C=O)C2CCC(CN(Cc3ccccc3)S(=O)(=O)c3cc(F)ccc3F)CC2)cc1

nearest known ligand 0.51

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TAS2R14 Q9NYV8 14/20 0.51
KCNA5 P22460 1/20 0.43
PTPN1 P18031 1/20 0.40
LMNA P02545 1/20 0.40
CNR1 P21554 1/20 0.39
CNR2 P34972 1/20 0.39
MAPT P10636 1/20 0.38
DPP4 P27487 1/20 0.38
DPP9 Q86TI2 1/20 0.38
DPP7 Q9UHL4 1/20 0.38
TP53 P04637 1/20 0.38

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
SCHEMBL3851814 0.94 TAS2R14 (0.50) TAS2R14KCNA5LMNACNR1CNR2
SCHEMBL3850841 0.94 TAS2R14 (0.50) TAS2R14KCNA5LMNACNR1CNR2
SCHEMBL3860650 0.92 TAS2R14 (0.50) TAS2R14KCNA5LMNACNR1CNR2
SCHEMBL3861362 0.91 TAS2R14 (0.52) TAS2R14KCNA5LMNACNR1CNR2
SCHEMBL3851378 0.89 LMNA (0.49) TAS2R14KCNA5LMNACNR1CNR2
SCHEMBL3854318 0.88 TAS2R14 (0.54) TAS2R14KCNA5LMNACNR1CNR2
SCHEMBL3849136 0.87 TAS2R14 (0.53) TAS2R14KCNA5LMNACNR1CNR2
SCHEMBL3852851 0.87 TAS2R14 (0.56) TAS2R14LMNACNR1CNR2TP53
SCHEMBL3853109 0.87 TAS2R14 (0.55) TAS2R14LMNACNR1CNR2TP53
SCHEMBL3860195 0.87 TAS2R14 (0.64) TAS2R14KCNA5LMNACNR1CNR2

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-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

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 4736/4885KCNA5 2414/4885PTPN1 4004/4885

“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.