SCHEMBL2866428

SCHEMBL2866428

CCCN(CCC)c1c(CC)nc2c(-c3ccc(Br)cc3F)nccn12

nearest known ligand 0.37

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAP4K4 O95819 3/20 0.37
MAPK9 P45984 3/20 0.37
CSNK1A1 P48729 3/20 0.37
CSNK1D P48730 3/20 0.37
MINK1 Q8N4C8 3/20 0.37
PRKD3 O94806 2/20 0.37
CSNK1G3 Q9Y6M4 2/20 0.37
SLC6A2 P23975 1/20 0.31
PRKD2 Q9BZL6 2/20 0.31
MAPK14 Q16539 1/20 0.31
MAP4K5 Q9Y4K4 1/20 0.31
CRHR1 P34998 1/20 0.31
PRKCG P05129 1/20 0.30
EPHA2 P29317 1/20 0.30
MAPK8 P45983 1/20 0.30
GSK3B P49841 1/20 0.30
CSNK1G2 P78368 1/20 0.30
TAOK1 Q7L7X3 1/20 0.30
CLK4 Q9HAZ1 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
SCHEMBL2869329 0.90 SLC6A2 (0.32) SLC6A2CRHR1
SCHEMBL2874015 0.88 CRHR1 (0.39) CRHR1
SCHEMBL2860920 0.82 CRHR1 (0.35) CRHR1
SCHEMBL2868097 0.81 CRHR1 (0.43) CRHR1
SCHEMBL2868190 0.80 CRHR1 (0.40) CRHR1
SCHEMBL2865995 0.80 CRHR1 (0.39) CRHR1
SCHEMBL2862167 0.80 CRHR1 (0.39) CRHR1
SCHEMBL2868182 0.79 CRHR1 (0.50) CRHR1
Hydrochloric Acid SCHEMBL2871892 0.78 CRHR1 (0.49) CRHR1
SCHEMBL2870835 0.78

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-7772249-B2 Imidazo[1,2-b]pyridazine compound EISAI R&D MANAGEMENT CO., LTD. (JP) 2010-08-10 US disclosed
US-20090181985-A1 IMIDAZO[1,2-b]PYRIDAZINE COMPOUND EISAI R&D MANAGEMENT CO., LTD. (JP) 2009-07-16 US disclosed
US-7078405-B2 Imidazo[1,2-b]pyridazine compound EISAI CO., LTD. (JP) 2006-07-18 US disclosed
US-20040082781-A1 Bicyclic nitrogenous fused-ring compound EISAI R&D MANAGEMENT CO., LTD. (JP) 2004-04-29 US disclosed
EP-1364952-A1 BICYCLIC NITROGENOUS FUSED-RING COMPOUND Eisai Co., Ltd. (JP) 2003-11-26 EP 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-20090181985-A1 IMIDAZO[1,2-b]PYRIDAZINE COMPOUND CRHR1, CRHR2, CRH MAP4K4 1018/4885MAPK9 1987/4885CSNK1A1 319/4885
US-20040082781-A1 Bicyclic nitrogenous fused-ring compound CRHR1, CRH, CRHR2 MAP4K4 2376/4885MAPK9 1739/4885CSNK1A1 627/4885

“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.