SCHEMBL12434788

SCHEMBL12434788

Cc1ccc(-c2cc(Cl)ccc2Cl)c(CO)c1

nearest known ligand 0.39

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
S1PR4 O95977 4/20 0.39
PSEN1 P49768 14/20 0.39
PSEN2 P49810 14/20 0.39
APH1B Q8WW43 14/20 0.39
NCSTN Q92542 14/20 0.39
APH1A Q96BI3 14/20 0.39
PSENEN Q9NZ42 14/20 0.39
S1PR2 O95136 1/20 0.38
SCN10A Q9Y5Y9 1/20 0.37

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
SCHEMBL12189590 0.78 HSD11B1 (0.44) S1PR4SCN10A
SCHEMBL320779 0.78 HTR2A (0.41) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL30707530 0.78 HTR2A (0.41) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL7846062 0.77 S1PR4 (0.45) S1PR4SCN10A
SCHEMBL12512413 0.76 LMNA (0.43) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL25450675 0.74 TP53 (0.41)
SCHEMBL25450664 0.74 TRPA1 (0.48)
SCHEMBL14686270 0.74 DPP4 (0.48)
SCHEMBL12434794 0.73 L3MBTL1 (0.46)
SCHEMBL278031 0.73 S1PR4 (0.45) S1PR4

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8440702-B2 1,3-oxazolidin -2-one derivatives useful as CETP inhibitors MERCK SHARP & DOHME CORP. (US) 2013-05-14 US disclosed
US-20110178059-A1 1,3-OXAZOLIDIN -2-ONE DERIVATIVES USEFUL AS CETP INHIBITORS MERCK SHARP & DOHME CORP. (US) 2011-07-21 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-20110178059-A1 1,3-OXAZOLIDIN -2-ONE DERIVATIVES USEFUL AS CETP INHIBITORS CETP, MTTP, APOB S1PR4 2762/4885PSEN1 1091/4885PSEN2 1912/4885

“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.