SCHEMBL3965862

SCHEMBL3965862

COC(=O)c1cc(Oc2ccc(F)cc2F)ccc1I

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSPB1 P04792 1/20 0.44
LMNA P02545 1/20 0.43
MAPK14 Q16539 1/20 0.43
SCN8A Q9UQD0 1/20 0.41
SCN10A Q9Y5Y9 1/20 0.41
NPC1 O15118 1/20 0.41
GAA P10253 1/20 0.41
RAB9A P51151 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
PNLIP P16233 1/20 0.41
TDP1 Q9NUW8 1/20 0.40
SCN4A P35499 1/20 0.40
TRPA1 O75762 2/20 0.40
MET P08581 3/20 0.40
AR P10275 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2C19 P33261 1/20 0.40
HIF1A Q16665 1/20 0.39
FFAR4 Q5NUL3 1/20 0.39

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
SCHEMBL13715381 0.85 HSPB1 (0.47) HSPB1LMNAMAPK14PNLIPSCN4A
SCHEMBL1151008 0.81 SLC6A4 (0.47) LMNANPC1RAB9ASMN1; SMN2CYP1A2
SCHEMBL9480232 0.81 KDM4E (0.47) LMNAGAATDP1CYP1A2CYP2C19
SCHEMBL13715246 0.81 PLA2G2A (0.41) HSPB1LMNAMAPK14SCN8ASCN10A
SCHEMBL4851442 0.80 TDP1 (0.65) HSPB1LMNATDP1
SCHEMBL13715197 0.79 PLA2G2A (0.40) HSPB1LMNAMAPK14SCN8ASCN10A
SCHEMBL15669422 0.79 NPC1 (0.53) HSPB1LMNANPC1GAARAB9A
SCHEMBL13715276 0.77 FFAR4 (0.39) HSPB1LMNAMAPK14SCN8ASCN10A
SCHEMBL11860422 0.76 SLC6A3 (0.55) LMNANPC1RAB9ASMN1; SMN2PNLIP
SCHEMBL3888953 0.76 POLB (0.38) HSPB1LMNAMAPK14SCN8ASCN10A

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-7572783-B2 Obesity; N-(1-benzyl-piperidin-4-yl)-2-(2,5-dioxo-7-phenoxy-1,2,3,5-tetrahydro-benzo[e][1,4]diazepin-4-yl)-3-methyl-butyramide; modulators of ghrelin receptor (GHSR) AMGEN INC. (US) 2009-08-11 US disclosed
US-7572783-B2 Obesity; N-(1-benzyl-piperidin-4-yl)-2-(2,5-dioxo-7-phenoxy-1,2,3,5-tetrahydro-benzo[e][1,4]diazepin-4-yl)-3-methyl-butyramide; modulators of ghrelin receptor (GHSR) AMGEN INC. (US) 2009-08-11 US disclosed
US-7572783-B2 Obesity; N-(1-benzyl-piperidin-4-yl)-2-(2,5-dioxo-7-phenoxy-1,2,3,5-tetrahydro-benzo[e][1,4]diazepin-4-yl)-3-methyl-butyramide; modulators of ghrelin receptor (GHSR) AMGEN INC. (US) 2009-08-11 US disclosed
US-20060199796-A1 Substituted benzofused heterocycles AMGEN INC. (US) 2006-09-07 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-20060199796-A1 Substituted benzofused heterocycles GPR119, SDHA, OGDH HSPB1 3323/4885LMNA 3352/4885MAPK14 2997/4885

“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.