SCHEMBL3410307

SCHEMBL3410307

O=C(CN(c1ccccc1)C1CC1)Nc1ccc(F)cc1

nearest known ligand 0.50

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.46
MEN1 O00255 1/20 0.46
LMNA P02545 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
GAA P10253 1/20 0.44
NPC1 O15118 1/20 0.44
RAB9A P51151 1/20 0.44
KLK7 P49862 1/20 0.44
MAPT P10636 2/20 0.44
ALDH1A1 P00352 1/20 0.43

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
SCHEMBL3402515 0.77 OPRM1 (0.44) KMT2AMEN1LMNASMN1; SMN2GAA
SCHEMBL3301596 0.74 ALDH1A1 (0.61) KMT2AMEN1LMNASMN1; SMN2GAA
SCHEMBL2037132 0.74 ALDH1A1 (0.51) KMT2AMEN1LMNASMN1; SMN2NPC1
SCHEMBL3409354 0.73 HDAC1 (0.45) KMT2AMEN1LMNASMN1; SMN2GAA
SCHEMBL3404199 0.73 MEN1 (0.49) KMT2AMEN1LMNASMN1; SMN2NPC1
SCHEMBL12727851 0.73 GAA (0.44) LMNASMN1; SMN2GAAKLK7ALDH1A1
SCHEMBL2346348 0.71 ALDH1A1 (0.47) KMT2AMEN1LMNASMN1; SMN2NPC1
SCHEMBL3407629 0.71 KDM1A (0.46) KMT2AMEN1LMNAGAAMAPT
SCHEMBL1575208 0.71 GRIN2B (0.54) KMT2ALMNASMN1; SMN2GAANPC1
SCHEMBL1574710 0.69 GRIN2B (0.52) KMT2ALMNASMN1; SMN2GAANPC1

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-2177502-A1 Compounds and their use Oryzon Genomics, S.A. (ES) 2010-04-21 EP claimed
EP-2177502-A1 Compounds and their use Oryzon Genomics, S.A. (ES) 2010-04-21 EP disclosed