SCHEMBL6778747

SCHEMBL6778747

COc1ccc(CN(C(=O)c2ccccc2)c2ccccc2OC)cc1

nearest known ligand 0.55

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.55
RAB9A P51151 1/20 0.55
LPAR1 Q92633 6/20 0.52
LPAR5 Q9H1C0 6/20 0.52
MEN1 O00255 2/20 0.51
KMT2A Q03164 2/20 0.51
ACHE P22303 1/20 0.51
TSHR P16473 3/20 0.51
TDP1 Q9NUW8 1/20 0.51
ALDH1A1 P00352 2/20 0.50
MAPK1 P28482 2/20 0.50
POLB P06746 1/20 0.50
BCL2A1 Q16548 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
KDM4E B2RXH2 1/20 0.48
HSD17B10 Q99714 1/20 0.48
LMNA P02545 1/20 0.47

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
SCHEMBL6784816 0.86 PTGES (0.60) NPC1RAB9ALPAR1LPAR5ALDH1A1
SCHEMBL6779305 0.86 PTGES (0.53) NPC1RAB9ALPAR1LPAR5MEN1
SCHEMBL6783932 0.83 NPC1 (0.70) NPC1RAB9AMEN1KMT2AACHE
SCHEMBL6778659 0.83 ALDH1A1 (0.49) MEN1KMT2ATDP1ALDH1A1BCL2A1
SCHEMBL30958894 0.82 POLB (0.62) NPC1RAB9ALPAR1MEN1KMT2A
SCHEMBL22100763 0.82 NPC1 (0.65) NPC1RAB9ALPAR1LPAR5MEN1
SCHEMBL30522587 0.81 NPC1 (0.70) NPC1RAB9AMEN1KMT2AACHE
SCHEMBL14542054 0.78 TSPO (0.62) TSHRALDH1A1MAPK1SMN1; SMN2
SCHEMBL6775052 0.77 HTT (0.49) LPAR1MEN1KMT2AALDH1A1MAPK1
SCHEMBL5491922 0.76 NPC1 (0.68) NPC1RAB9AMEN1KMT2AACHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20020156281-A1 Amide inhibitors of microsomal triglyceride transfer protein BOOTH RICHARD JOHN (US) 2002-10-24 US claimed
US-6780883-B2 ANTICHOLESTEROL AGENTS; CARDIOVASCULAR DISORDERS; ANTILIPEMIC AGENTS; RESTENOSIS; DIETETICS WARNER-LAMBERT COMPANY 2004-08-24 US disclosed
US-20020156281-A1 Amide inhibitors of microsomal triglyceride transfer protein BOOTH RICHARD JOHN (US) 2002-10-24 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-20020156281-A1 Amide inhibitors of microsomal triglyceride transfer protein CETP, MTTP, LCAT NPC1 35/4885RAB9A 2995/4885LPAR1 2233/4885

“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.