SCHEMBL12427583

SCHEMBL12427583

CBc1ccc2c(c1)C(c1nc(NCCCN(C)C)nc3nn(CCC)cc13)C(=O)N2

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TRIM58 Q8NG06 2/20 0.33
EHMT2 Q96KQ7 3/20 0.31
KDM1A O60341 2/20 0.31
RCOR1 Q9UKL0 2/20 0.31
EHMT1 Q9H9B1 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
SCHEMBL2076699 0.89 EGFR (0.34) TRIM58EHMT2KDM1ARCOR1EHMT1
SCHEMBL2078688 0.84 USP2 (0.34)
SCHEMBL14206419 0.81 BCDIN3D (0.32)
SCHEMBL2078758 0.81 EHMT2 (0.34) EHMT2KDM1ARCOR1EHMT1
SCHEMBL2075562 0.80 USP2 (0.35)
SCHEMBL3773255 0.80 USP2 (0.34)
SCHEMBL2077706 0.80 USP2 (0.35) TRIM58EHMT2KDM1ARCOR1
SCHEMBL2076201 0.79 EGFR (0.32) EHMT2KDM1ARCOR1
Hydrochloric Acid SCHEMBL2078049 0.79 USP2 (0.34)
SCHEMBL2075420 0.79 USP2 (0.35)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2351751-A1 Substituted pyrazolopyrimidines CEPHALON, INC. (US) 2011-08-03 EP disclosed
WO-2008063232-A2 SUBSTITUTED PYRAZOLOPYRIMIDINES CEPHALON, INC. (US) 2008-05-29 WO disclosed