SCHEMBL5030401

SCHEMBL5030401

CCCc1nc2c(c(C)c(C)n3nnnc23)n1CC(C)(C)NC(=O)NC1CCCCC1

nearest known ligand 0.38

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 2/20 0.38
AGTR1 P30556 1/20 0.34
AGTR2 P50052 1/20 0.34
GAA P10253 3/20 0.33
TDP1 Q9NUW8 1/20 0.33
KMT2A Q03164 2/20 0.32
MEN1 O00255 1/20 0.32
RECQL P46063 1/20 0.32
ALDH1A1 P00352 2/20 0.32
MAPT P10636 2/20 0.32
MAPK13 O15264 1/20 0.32
MAPK12 P53778 1/20 0.32
MAPK11 Q15759 1/20 0.32
MAPK14 Q16539 1/20 0.32
HPGD P15428 1/20 0.31
RAB9A P51151 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
KDM4E B2RXH2 1/20 0.31

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
SCHEMBL5030333 0.95 EPHX1 (0.36) EPHX1AGTR1AGTR2KMT2AMEN1
SCHEMBL5034584 0.91 EPHX1 (0.36) EPHX1GAATDP1KMT2AMEN1
SCHEMBL13996160 0.81 EPHX1 (0.40) EPHX1AGTR1AGTR2GAATDP1
SCHEMBL5031326 0.80 TLR7 (0.38) AGTR1AGTR2KMT2AMEN1MAPT
SCHEMBL5030382 0.76 TLR7 (0.40) EPHX1MAPT
SCHEMBL1490742 0.74 EPHX1 (0.41) EPHX1
SCHEMBL5030389 0.72 TLR8 (0.33)
SCHEMBL5027812 0.72 EPHX1 (0.45) EPHX1GAAKMT2AMEN1RECQL
SCHEMBL6451965 0.72 EPHX1 (0.38) EPHX1GAATDP1MAPT
Water SCHEMBL5030360 0.71 EPHX1 (0.38) EPHX1GAATDP1MAPT

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-20080312434-A1 PROCESS FOR IMIDAZO [4,5-C] PYRIDIN-4-AMINES COLEY PHARMACEUTICAL GROUP, INC. (US) 2008-12-18 US disclosed
US-20080312434-A1 PROCESS FOR IMIDAZO [4,5-C] PYRIDIN-4-AMINES COLEY PHARMACEUTICAL GROUP, INC. (US) 2008-12-18 US disclosed
US-20080312434-A1 PROCESS FOR IMIDAZO [4,5-C] PYRIDIN-4-AMINES COLEY PHARMACEUTICAL GROUP, INC. (US) 2008-12-18 US disclosed
US-20050032829-A1 Process for imidazo[4,5-c]pyridin-4-amines 3M INNOVATIVE PROPERTIES COMPANY 2005-02-10 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-20080312434-A1 PROCESS FOR IMIDAZO [4,5-C] PYRIDIN-4-AMINES PAICS, HTR4, PNPO EPHX1 2287/4885AGTR1 1702/4885AGTR2 2030/4885
US-20050032829-A1 Process for imidazo[4,5-c]pyridin-4-amines PAICS, HTR4, PNPO EPHX1 2287/4885AGTR1 1702/4885AGTR2 2030/4885

“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.