SCHEMBL3856007

SCHEMBL3856007

COC(=O)c1ccc(CNC(=O)C2CCC(CN(Cc3ccccc3C)S(=O)(=O)c3ccccc3)CC2)cc1

nearest known ligand 0.52

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 2/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
TAS2R14 Q9NYV8 13/20 0.48
LMNA P02545 1/20 0.45
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
CXCR3 P49682 1/20 0.43

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
SCHEMBL5315438 0.92 TAS2R14 (0.56) MAPK1SMN1; SMN2TAS2R14LMNAMEN1
SCHEMBL3856384 0.90 TAS2R14 (0.56) MAPK1TAS2R14LMNACXCR3
SCHEMBL13714165 0.90 TAS2R14 (0.59) MAPK1SMN1; SMN2TAS2R14MEN1KMT2A
SCHEMBL3851328 0.90 TAS2R14 (0.59) MAPK1SMN1; SMN2TAS2R14MEN1KMT2A
SCHEMBL3856789 0.88 PTGES (0.57) MAPK1TAS2R14LMNAMEN1KMT2A
SCHEMBL13714179 0.81 TAS2R14 (0.59) TAS2R14MEN1KMT2A
SCHEMBL3853015 0.81 TAS2R14 (0.72) MAPK1TAS2R14LMNAMEN1KMT2A
SCHEMBL3852268 0.81 PTGES (0.61) TAS2R14LMNAMEN1KMT2ACXCR3
SCHEMBL3858876 0.80 TAS2R14 (0.55) TAS2R14MEN1KMT2A
SCHEMBL5337346 0.79 TAS2R14 (0.52) MAPK1SMN1; SMN2TAS2R14LMNA

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 MAPK1 3135/4885SMN1; SMN2 4609/4885TAS2R14 4736/4885

“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.