SCHEMBL3856035

SCHEMBL3856035

CN(Cc1ccccc1)C(=O)C1CCC(CN(Cc2ccc(F)cc2)S(=O)(=O)c2ccccc2)CC1

nearest known ligand 0.77

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TAS2R14 Q9NYV8 17/20 0.77
LMNA P02545 1/20 0.55
KCNA5 P22460 1/20 0.53
MAPK1 P28482 1/20 0.52
TP53 P04637 1/20 0.51
POLB P06746 1/20 0.51
TDP1 Q9NUW8 1/20 0.51

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
SCHEMBL3856363 0.94 TAS2R14 (0.69) TAS2R14LMNAMAPK1TP53POLB
SCHEMBL1279003 0.87 TAS2R14 (1.00) TAS2R14LMNAKCNA5TP53POLB
SCHEMBL3851680 0.80 TAS2R14 (0.74) TAS2R14KCNA5
SCHEMBL1279109 0.80 TAS2R14 (1.00) TAS2R14LMNATP53POLBTDP1
SCHEMBL1616132 0.78 TAS2R14 (1.00) TAS2R14LMNAKCNA5TP53POLB
SCHEMBL1615055 0.78 TAS2R14 (1.00) TAS2R14TP53
SCHEMBL1279599 0.77 TAS2R14 (1.00) TAS2R14KCNA5TP53POLBTDP1
SCHEMBL1279268 0.76 TAS2R14 (1.00) TAS2R14LMNAMAPK1TP53
SCHEMBL1615476 0.76 TAS2R14 (1.00) TAS2R14LMNATP53POLBTDP1
SCHEMBL5790489 0.76 POLB (0.69) POLB

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 6 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
WO-2007067817-A1 ABCA1 ELEVATING COMPOUNDS CV THERAPEUTICS, INC. (US) 2007-06-14 WO 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 830/4885KCNA5 2414/4885

“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.