SCHEMBL20744403

SCHEMBL20744403

O=C(O)N1CCC(COc2ccccc2O)C1

nearest known ligand 0.55

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
RBP4 P02753 12/20 0.55
CYP2C9 P11712 1/20 0.43
CYP2C19 P33261 1/20 0.43
MAPK14 Q16539 1/20 0.43
TACR3 P29371 1/20 0.43
TTR P02766 8/20 0.43
MEN1 O00255 1/20 0.40
APOBEC3A P31941 1/20 0.40
KMT2A Q03164 1/20 0.40
APOBEC3G Q9HC16 1/20 0.40

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
SCHEMBL19205350 0.83 RBP4 (0.59) RBP4CYP2C9CYP2C19MAPK14MEN1
SCHEMBL19205395 0.83 RBP4 (0.59) RBP4CYP2C9CYP2C19MAPK14MEN1
SCHEMBL5207932 0.83 RBP4 (0.52) RBP4TTRMEN1KMT2A
SCHEMBL20744513 0.83 RBP4 (0.52) RBP4CYP2C9CYP2C19MAPK14TACR3
SCHEMBL19205428 0.83 RBP4 (0.57) RBP4CYP2C9CYP2C19MAPK14MEN1
SCHEMBL20744476 0.83 RBP4 (0.54) RBP4
SCHEMBL25416553 0.82 RBP4 (0.62) RBP4CYP2C9CYP2C19MAPK14TTR
SCHEMBL30544350 0.82 RBP4 (0.62) RBP4CYP2C9CYP2C19MAPK14TTR
SCHEMBL19205310 0.82 RBP4 (0.60) RBP4MEN1KMT2A
SCHEMBL19205454 0.80 RBP4 (0.52) RBP4CYP2C9CYP2C19MAPK14TACR3

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-3668877-A1 INDOLE DERIVATIVES AS HISTONE DEMETHYLASE INHIBITORS Istituto Europeo di Oncologia S.r.l. (IT) 2020-06-24 EP disclosed
WO-2019034774-A1 INDOLE DERIVATIVES AS HISTONE DEMETHYLASE INHIBITORS ISTITUTO EUROPEO DI ONCOLOGIA (IEO) S.R.L. (IT) 2019-02-21 WO disclosed