SCHEMBL6699799

SCHEMBL6699799

CC(C)c1ccc(-c2c(C(=O)Nc3ccc(N4CCN(C(C)C)CC4)nc3)cccc2C(C)C)cc1

nearest known ligand 0.56

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.49
PANK3 Q9H999 7/20 0.46
RAB9A P51151 4/20 0.46
CYP1A2 P05177 1/20 0.46
PTPN11 Q06124 1/20 0.43
PPARG P37231 1/20 0.42
MT-CO2 P00403 1/20 0.41
NTRK1 P04629 1/20 0.41
NPC1 O15118 1/20 0.41

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
SCHEMBL6698288 0.92 L3MBTL1 (0.60) L3MBTL1PANK3RAB9ACYP1A2PPARG
SCHEMBL6698256 0.89 PANK3 (0.48) L3MBTL1PANK3RAB9ACYP1A2PPARG
SCHEMBL6702911 0.88 L3MBTL1 (0.48) L3MBTL1PANK3RAB9ACYP1A2PTPN11
SCHEMBL7253740 0.73 MT-CO2 (0.55) L3MBTL1PANK3RAB9APTPN11MT-CO2
SCHEMBL7253746 0.72 ALDH1A1 (0.45) PANK3RAB9AMT-CO2NPC1
SCHEMBL7253800 0.72 ALDH1A1 (0.45) PANK3RAB9AMT-CO2NPC1
SCHEMBL7258378 0.72 MAPT (0.54) RAB9ANPC1
SCHEMBL14758314 0.72 TRPV4 (0.66) L3MBTL1RAB9A
SCHEMBL2826663 0.72 PTPN11 (0.54) L3MBTL1PANK3RAB9ACYP1A2PTPN11
SCHEMBL7253222 0.71 MAPT (0.51) L3MBTL1PANK3RAB9APTPN11NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040009988-A1 Bioisosteric bensamide derivatives and their use as apob-100 secretion inhibitors SMITHKLINE BEECHAM CORPORATION 2004-01-15 US claimed
EP-1289982-A1 BIOISOSTERIC BENZAMIDE DERIVATIVES AND THEIR USE AS APOB-100 SECRETION INHIBITORS GLAXO GROUP LIMITED (GB) 2003-03-12 EP claimed
WO-2001096327-A1 BIOISOSTERIC BENZAMIDE DERIVATIVES AND THEIR USE AS APoB-100 SECRETION INHIBITORS GLAXO GROUP LIMITED (GB) 2001-12-20 WO claimed
US-20040009988-A1 Bioisosteric bensamide derivatives and their use as apob-100 secretion inhibitors SMITHKLINE BEECHAM CORPORATION 2004-01-15 US disclosed
EP-1289982-A1 BIOISOSTERIC BENZAMIDE DERIVATIVES AND THEIR USE AS APOB-100 SECRETION INHIBITORS GLAXO GROUP LIMITED (GB) 2003-03-12 EP disclosed
WO-2001096327-A1 BIOISOSTERIC BENZAMIDE DERIVATIVES AND THEIR USE AS APoB-100 SECRETION INHIBITORS GLAXO GROUP LIMITED (GB) 2001-12-20 WO 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-20040009988-A1 Bioisosteric bensamide derivatives and their use as apob-100 secretion inhibitors APOB, APOL1, TTR L3MBTL1 1904/4885PANK3 4777/4885RAB9A 3835/4885

“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.