SCHEMBL3889792

SCHEMBL3889792

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

nearest known ligand 0.65

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.61
KMT2A Q03164 2/20 0.56
ALDH1A1 P00352 2/20 0.56
LMNA P02545 1/20 0.56
NR1H4 Q96RI1 1/20 0.51
HTT P42858 2/20 0.51
MEN1 O00255 1/20 0.51
PTGER4 P35408 4/20 0.50
PTGER2 P43116 2/20 0.50
BACE1 P56817 3/20 0.47
KDM4E B2RXH2 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
ROCK2 O75116 2/20 0.46
ROCK1 Q13464 2/20 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
SCHEMBL7864711 1.00 NPC1 (0.61) NPC1KMT2AALDH1A1LMNANR1H4
SCHEMBL13229299 0.88 NPC1 (0.59) NPC1KMT2AALDH1A1LMNANR1H4
SCHEMBL13229362 0.88 NPC1 (0.59) NPC1KMT2AALDH1A1LMNANR1H4
SCHEMBL3889350 0.87 ALDH1A1 (0.57) NPC1KMT2AALDH1A1LMNANR1H4
SCHEMBL3889347 0.87 ALDH1A1 (0.57) NPC1KMT2AALDH1A1LMNANR1H4
SCHEMBL7866401 0.86 LMNA (0.56) NPC1KMT2AALDH1A1LMNAHTT
SCHEMBL3895800 0.86 LMNA (0.56) NPC1KMT2AALDH1A1LMNAHTT
SCHEMBL13042147 0.83 KMT2A (0.60) NPC1KMT2AALDH1A1LMNANR1H4
SCHEMBL4784087 0.83 NPC1 (0.51) NPC1KMT2AALDH1A1LMNAHTT
SCHEMBL13229283 0.82 NPC1 (0.59) NPC1KMT2AALDH1A1LMNANR1H4

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-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

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 NPC1 553/4885KMT2A 2775/4885ALDH1A1 3847/4885

“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.