SCHEMBL3850844

SCHEMBL3850844

Cc1ccc(C(C(N)=O)C2CCC(CN(Cc3ccccc3)S(=O)(=O)c3cc(F)ccc3C)CC2)cc1

nearest known ligand 0.49

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TAS2R14 Q9NYV8 16/20 0.49
LMNA P02545 1/20 0.39
TP53 P04637 1/20 0.39
ATM Q13315 1/20 0.39
ALDH1A1 P00352 1/20 0.39
MAPK1 P28482 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
SCHEMBL3856888 0.94 TAS2R14 (0.50) TAS2R14LMNATP53ATMALDH1A1
SCHEMBL3860654 0.93 TAS2R14 (0.49) TAS2R14LMNATP53ATMALDH1A1
SCHEMBL3851818 0.92 TAS2R14 (0.49) TAS2R14LMNATP53ATM
SCHEMBL3861367 0.89 TAS2R14 (0.53) TAS2R14LMNATP53ALDH1A1MAPK1
SCHEMBL3849137 0.87 TAS2R14 (0.55) TAS2R14LMNATP53MAPK1
SCHEMBL3853112 0.87 TAS2R14 (0.56) TAS2R14LMNATP53ATMMAPK1
SCHEMBL3851679 0.87 TAS2R14 (0.56) TAS2R14LMNATP53MAPK1
SCHEMBL3860197 0.86 TAS2R14 (0.65) TAS2R14ATM
SCHEMBL3851744 0.86 TAS2R14 (0.55) TAS2R14LMNATP53MAPK1
SCHEMBL3851379 0.85 LMNA (0.51) TAS2R14LMNATP53ALDH1A1

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 4736/4885LMNA 830/4885TP53 4391/4885

“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.