SCHEMBL23907014

SCHEMBL23907014

Cc1c(Br)c(=O)n(-c2ccc(C(C)C)cc2)n1C

nearest known ligand 0.52

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.52
MEN1 O00255 4/20 0.52
LMNA P02545 1/20 0.51
ADORA3 P0DMS8 1/20 0.51
FPR2 P25090 1/20 0.48
ALDH1A1 P00352 2/20 0.44
GAA P10253 1/20 0.44
KDM4E B2RXH2 1/20 0.43
CYP1A2 P05177 1/20 0.43
CYP2D6 P10635 1/20 0.43
POLB P06746 1/20 0.42
MGLL Q99685 1/20 0.42
BCHE P06276 1/20 0.41
PTGS2 P35354 1/20 0.41
ALOX15 P16050 1/20 0.41

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
SCHEMBL23907025 0.83 GAA (0.48) KMT2AMEN1LMNAADORA3FPR2
SCHEMBL23907007 0.83 ALDH1A1 (0.46) KMT2AMEN1LMNAADORA3FPR2
SCHEMBL23907016 0.80 KMT2A (0.40) KMT2AMEN1LMNAADORA3FPR2
SCHEMBL3528653 0.80 KMT2A (0.51) KMT2AMEN1LMNAADORA3FPR2
SCHEMBL23907012 0.80 BCHE (0.64) KMT2AMEN1LMNAADORA3ALDH1A1
SCHEMBL23907006 0.77 BCHE (0.53) KMT2AMEN1LMNAADORA3ALDH1A1
SCHEMBL23907011 0.76 FPR2 (0.49) KMT2AMEN1LMNAADORA3FPR2
SCHEMBL23907022 0.73 MAPT (0.47) KMT2AMEN1LMNAFPR2ALDH1A1
SCHEMBL23907013 0.73 BCHE (0.39) KMT2AMEN1LMNAADORA3ALDH1A1
SCHEMBL15614523 0.72 LMNA (0.71) KMT2AMEN1LMNAADORA3FPR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3892734-B1 SCREENING METHODS AND THERAPEUTIC APPLICATIONS BASED ON BACTERIAL MOTILITY INHIBITION UNIV MUENCHEN LUDWIG MAXIMILIANS (DE) 2024-08-28 EP disclosed
EP-3892734-A1 SCREENING METHODS AND THERAPEUTIC APPLICATIONS BASED ON BACTERIAL MOTILITY INHIBITION Ludwig-Maximilians-Universität München (DE) 2021-10-13 EP disclosed
EP-3892734-A1 SCREENING METHODS AND THERAPEUTIC APPLICATIONS BASED ON BACTERIAL MOTILITY INHIBITION Ludwig-Maximilians-Universität München (DE) 2021-10-13 EP disclosed