SCHEMBL4664638

SCHEMBL4664638

Cc1nc2c(O)c(CC(O)Cc3ccccc3)c(C(=O)N(C)C)cc2n1COCC[Si](C)(C)C

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
F11 P03951 1/20 0.37
NPC1 O15118 1/20 0.34
BRD4 O60885 1/20 0.33
HDAC8 Q9BY41 1/20 0.31
PPARG P37231 2/20 0.31
PPARA Q07869 1/20 0.31
F2 P00734 2/20 0.31
F10 P00742 2/20 0.31
KDM4E B2RXH2 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
DGAT1 O75907 1/20 0.31
PDK1 Q15118 1/20 0.31
PDK2 Q15119 1/20 0.31
PDK3 Q15120 1/20 0.31
PDK4 Q16654 1/20 0.31
USP19 O94966 1/20 0.30
PRKCI P41743 1/20 0.30

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
SCHEMBL5109499 0.85 NPC1 (0.33) F11NPC1
SCHEMBL5109495 0.85 NPC1 (0.33) F11NPC1
SCHEMBL4664634 0.83 NPC1 (0.36) NPC1BRD4F2F10
SCHEMBL5118501 0.82 NPC1 (0.33) NPC1
SCHEMBL4962499 0.82 NPC1 (0.33) NPC1
SCHEMBL4963099 0.81 NPC1 (0.34) NPC1
SCHEMBL4664584 0.74 BRD4 (0.43) NPC1BRD4F2F10SMN1; SMN2
SCHEMBL4664726 0.72 KDM4E (0.34) BRD4PPARGPPARAKDM4ESMN1; SMN2
SCHEMBL4664611 0.72 NPC1 (0.37) NPC1BRD4F2F10
SCHEMBL4963054 0.72 NPC1 (0.33) NPC1DGAT1

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-20080113963-A1 Cyclic benzimidazoles ALTANA PHARMA AG (DE) 2008-05-15 US disclosed
US-7307084-B2 Cyclic benzimidazoles ALTANA PHARMA AG (DE) 2007-12-11 US disclosed
US-20060194968-A1 Cyclic benizimidazoles ALTANA PHARMA AG (DE) 2006-08-31 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 (2 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-20060194968-A1 Cyclic benizimidazoles VIP, SI, GIPR F11 589/4885NPC1 2772/4885BRD4 85/4885
US-20080113963-A1 Cyclic benzimidazoles VIP, GIPR, SI F11 891/4885NPC1 2631/4885BRD4 1068/4885

“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.