SCHEMBL5568102

SCHEMBL5568102

COc1ccc(Nc2nc(C)cc(-n3ccc(-c4nccs4)n3)c2CCO)c(OC)c1

nearest known ligand 0.51

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CRHR1 P34998 11/20 0.51
MAPT P10636 2/20 0.40
KDM4E B2RXH2 1/20 0.40
GAA P10253 1/20 0.40
PKM P14618 1/20 0.40
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
HPGD P15428 2/20 0.37
SHMT2 P34897 1/20 0.36
CSNK2A1 P68400 1/20 0.36
MKNK2 Q9HBH9 1/20 0.35

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
SCHEMBL5569033 0.91 CRHR1 (0.51) CRHR1
SCHEMBL5572018 0.89 CRHR1 (0.49) CRHR1
SCHEMBL5571984 0.87 CRHR1 (0.47) CRHR1MAPTKDM4EGAAPKM
SCHEMBL5572212 0.87 CRHR1 (0.45) CRHR1
SCHEMBL5568871 0.86 CRHR1 (0.49) CRHR1
SCHEMBL5568075 0.84 CRHR1 (0.50) CRHR1
SCHEMBL5547345 0.84 CRHR1 (0.50) CRHR1
SCHEMBL5572074 0.84 CRHR1 (0.47) CRHR1
SCHEMBL5550638 0.81 CRHR1 (0.57) CRHR1
SCHEMBL5571989 0.81 CRHR1 (0.51) CRHR1MKNK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070066640-A1 Heteroaryl-substituted pyrrolo'2,3-b1 pyridine derivatives as crf receptor antagonists SMITHKLINE BEECHAM (CORK) LIMITED (IE) 2007-03-22 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-20070066640-A1 Heteroaryl-substituted pyrrolo'2,3-b1 pyridine derivatives as crf receptor antagonists CRHR1, CRHR2, CRH CRHR1 1/4885MAPT 3698/4885KDM4E 4352/4885

“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.