SCHEMBL17366178

SCHEMBL17366178

O=C1c2ccc(Br)cc2C(c2ccc(Cl)cc2)N1Cc1ccc([N+](=O)[O-])cc1

nearest known ligand 0.56

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MDM2 Q00987 14/20 0.56
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
TP53 P04637 3/20 0.45
CYP2C9 P11712 2/20 0.44
CYP2C19 P33261 2/20 0.44
ACHE P22303 1/20 0.42
POLB P06746 1/20 0.41
CYP1A2 P05177 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
SCHEMBL12332978 0.91 MDM2 (0.53) MDM2MEN1KMT2ATP53CYP2C9
SCHEMBL17366182 0.87 MDM2 (0.56) MDM2MEN1KMT2ATP53CYP2C9
SCHEMBL17366163 0.87 MDM2 (0.56) MDM2MEN1KMT2ATP53CYP2C9
SCHEMBL17366166 0.84 MDM2 (0.58) MDM2MEN1KMT2ATP53CYP2C9
SCHEMBL17366148 0.84 CYP2C9 (0.57) MDM2MEN1KMT2ATP53CYP2C9
SCHEMBL17366158 0.83 CYP2C9 (0.56) MDM2MEN1KMT2ACYP2C9CYP2C19
SCHEMBL17366164 0.80 MDM2 (0.53) MDM2MEN1KMT2ATP53CYP2C9
SCHEMBL17366183 0.80 MDM2 (0.53) MDM2MEN1KMT2ATP53CYP2C9
SCHEMBL17366184 0.78 MDM2 (0.46) MDM2MEN1KMT2ATP53CYP2C9
SCHEMBL17366165 0.78 MDM2 (0.55) MDM2MEN1KMT2ATP53CYP2C9

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-2960233-A1 NEW THERAPEUTIC AGENTS Cancer Research Technology Limited (GB) 2015-12-30 EP disclosed