SCHEMBL4337976

SCHEMBL4337976

CCC(CC)(CCn1ccn(CC(=O)c2cc3c(c(C(C)(C)C)c2)OCCN3C)c1=N)OC

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
F2R P25116 14/20 0.35
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
PTGS1 P23219 4/20 0.32
PTGS2 P35354 4/20 0.32
ALOX5 P09917 2/20 0.32

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
Bromide SCHEMBL5585079 0.99 F2R (0.35) F2RMEN1KMT2APTGS1PTGS2
SCHEMBL14346311 0.82 F2R (0.47) F2RMEN1KMT2APTGS1PTGS2
Bromide SCHEMBL4344870 0.81 F2R (0.46) F2RMEN1KMT2APTGS1PTGS2
SCHEMBL6366000 0.75 F2R (0.38) F2R
Bromide SCHEMBL4333522 0.75 F2R (0.38) F2R
SCHEMBL1189832 0.71 MEN1 (0.43) F2RMEN1KMT2APTGS1PTGS2
SCHEMBL13588612 0.71 MEN1 (0.43) F2RMEN1KMT2APTGS1PTGS2
SCHEMBL2083911 0.71 F2R (0.35) F2R
Bromide SCHEMBL6746455 0.70 F2R (0.65) F2RMEN1KMT2A
SCHEMBL3969535 0.70 F2R (0.35) F2R

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
EP-1391456-B1 2-IMINOIMIDAZOLE DERIVATIVES EISAI R&D MAN CO LTD (JP) 2009-07-22 EP disclosed
US-7304083-B2 2-iminoimidazole derivatives (2) EISAI R&D MANAGEMENT CO., LTD. (JP) 2007-12-04 US disclosed
US-7304083-B2 2-iminoimidazole derivatives (2) EISAI R&D MANAGEMENT CO., LTD. (JP) 2007-12-04 US disclosed
EP-1391456-A1 2-IMINOIMIDAZOLE DERIVATIVE (2) Eisai Co., Ltd. (JP) 2004-02-25 EP disclosed