SCHEMBL4664771

SCHEMBL4664771

CCc1nc2c(OCc3ccccc3)cc(Br)cc2n1C

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
RHEB Q15382 1/20 0.48
GCK P35557 2/20 0.42
RAB9A P51151 3/20 0.41
NPC1 O15118 2/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
SRD5A2 P31213 2/20 0.41
SRD5A1 P18405 1/20 0.41
MAOB P27338 1/20 0.40
SLC6A4 P31645 1/20 0.39
PTGER1 P34995 3/20 0.39
STAT3 P40763 1/20 0.39
HTT P42858 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
KDM1A O60341 2/20 0.38

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
SCHEMBL4662895 0.85 MEN1 (0.46) RHEBGCKRAB9ANPC1MEN1
SCHEMBL7978844 0.82 RHEB (0.49) RHEBRAB9ANPC1MEN1KMT2A
SCHEMBL4663138 0.82 GCK (0.45) RHEBGCKRAB9ANPC1MEN1
SCHEMBL4663154 0.81 PTGER1 (0.40) RHEBGCKRAB9ANPC1MEN1
SCHEMBL4662918 0.80 MCHR1 (0.51) RHEBRAB9ANPC1MEN1KMT2A
SCHEMBL4662927 0.79 BRD4 (0.48) RHEBRAB9ANPC1SRD5A2SRD5A1
SCHEMBL34475846 0.77 MAOB (0.43) RHEBGCKRAB9ANPC1MEN1
SCHEMBL18372654 0.76 TNF (0.47) GCKMEN1KMT2APTGER1STAT3
SCHEMBL30501926 0.76 TNF (0.47) GCKMEN1KMT2APTGER1STAT3
SCHEMBL4664857 0.74 GCK (0.40) GCKRAB9ANPC1MEN1KMT2A

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 5 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
EP-1613626-A1 CYCLIC BENZIMIDAZOLES ALTANA Pharma AG (DE) 2006-01-11 EP disclosed
WO-2004087701-A1 CYCLIC BENZIMIDAZOLES ALTANA PHARMA AG (DE) 2004-10-14 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 (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 RHEB 3582/4885GCK 332/4885RAB9A 4475/4885
US-20080113963-A1 Cyclic benzimidazoles VIP, GIPR, SI RHEB 2307/4885GCK 106/4885RAB9A 2004/4885

“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.