SCHEMBL7866401

SCHEMBL7866401

COC(=O)c1cc(C(C)=O)cc(C(=O)NC(C)c2ccc(F)cc2)c1

nearest known ligand 0.58

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.56
ALDH1A1 P00352 1/20 0.56
NPC1 O15118 1/20 0.55
KMT2A Q03164 2/20 0.53
HTT P42858 2/20 0.52
MEN1 O00255 1/20 0.52
ROCK2 O75116 10/20 0.52
ROCK1 Q13464 9/20 0.52
KDM4E B2RXH2 1/20 0.50
BACE1 P56817 1/20 0.50
PSEN1 P49768 1/20 0.46
PSEN2 P49810 1/20 0.46
APH1B Q8WW43 1/20 0.46
NCSTN Q92542 1/20 0.46
APH1A Q96BI3 1/20 0.46
PSENEN Q9NZ42 1/20 0.46

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
SCHEMBL3895800 1.00 LMNA (0.56) LMNAALDH1A1NPC1KMT2AHTT
SCHEMBL7869047 0.88 ALDH1A1 (0.59) LMNAALDH1A1NPC1KMT2AHTT
SCHEMBL13229366 0.88 ALDH1A1 (0.55) LMNAALDH1A1NPC1KMT2AHTT
SCHEMBL3889316 0.88 ALDH1A1 (0.59) LMNAALDH1A1NPC1KMT2AHTT
SCHEMBL3886903 0.86 ALDH1A1 (0.54) LMNAALDH1A1NPC1KMT2AHTT
SCHEMBL3889792 0.86 NPC1 (0.61) LMNAALDH1A1NPC1KMT2AHTT
SCHEMBL3886906 0.86 ALDH1A1 (0.54) LMNAALDH1A1NPC1KMT2AHTT
SCHEMBL7864711 0.86 NPC1 (0.61) LMNAALDH1A1NPC1KMT2AHTT
SCHEMBL13359830 0.83 ROCK2 (0.56) LMNAALDH1A1NPC1KMT2AHTT
SCHEMBL13229280 0.83 ROCK2 (0.56) LMNAALDH1A1NPC1KMT2AHTT

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-7476764-B2 Phenylcarboxyamides as beta-secretase inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2009-01-13 US disclosed
US-7476764-B2 Phenylcarboxyamides as beta-secretase inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2009-01-13 US disclosed
US-20070032470-A1 Novel phenylcarboxyamides as beta-secretase inhibitors BRISTOL-MYERS SQUIBB COMPANY 2007-02-08 US disclosed
US-20070032470-A1 Novel phenylcarboxyamides as beta-secretase inhibitors BRISTOL-MYERS SQUIBB COMPANY 2007-02-08 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-20070032470-A1 Novel phenylcarboxyamides as beta-secretase inhibitors BACE1, APP, BACE2 LMNA 609/4885ALDH1A1 3847/4885NPC1 553/4885

“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.