SCHEMBL14817845

SCHEMBL14817845

Cn1c(C(=O)N[C@H]2CCC[C@@H]2N)cc2cc(Cl)ccc21

nearest known ligand 0.56

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
RXFP1 Q9HBX9 1/20 0.56
AHR P35869 1/20 0.52
PHGDH O43175 10/20 0.49
MEN1 O00255 3/20 0.49
KMT2A Q03164 3/20 0.49
CNR1 P21554 2/20 0.48
HDAC3 O15379 1/20 0.43
HDAC1 Q13547 1/20 0.43
F10 P00742 1/20 0.42

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
SCHEMBL12507464 0.82 RXFP1 (0.47) RXFP1AHRPHGDHMEN1KMT2A
SCHEMBL11888197 0.82 RXFP1 (0.47) RXFP1AHRPHGDHMEN1KMT2A
SCHEMBL15045011 0.77 RXFP1 (0.46) RXFP1AHRPHGDHMEN1KMT2A
SCHEMBL1253301 0.76 RXFP1 (0.72) RXFP1AHRPHGDHMEN1KMT2A
SCHEMBL15045013 0.75 F10 (0.52) F10
SCHEMBL15045075 0.73 F10 (0.70) F10
SCHEMBL1857427 0.73 SMYD3 (0.67) F10
SCHEMBL13378793 0.73 SMYD3 (0.67) F10
SCHEMBL5371698 0.73 SMYD3 (0.67) F10
SCHEMBL13415456 0.72 RXFP1 (0.62) RXFP1AHRPHGDHMEN1KMT2A

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
EP-1405852-B9 DIAMINE DERIVATIVES DAIICHI SANKYO CO LTD (JP) 2013-03-27 EP disclosed