SCHEMBL23398682

SCHEMBL23398682

Cc1ccc(-c2cc(=O)n(-c3ccc(C)cc3)[nH]2)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 10/20 0.55
KDM4E B2RXH2 9/20 0.55
KMT2A Q03164 8/20 0.55
MEN1 O00255 7/20 0.55
LMNA P02545 7/20 0.55
HTT P42858 5/20 0.55
RAB9A P51151 4/20 0.54
CYP1A2 P05177 1/20 0.54
CYP3A4 P08684 1/20 0.54
CYP2C9 P11712 1/20 0.54
CYP2C19 P33261 1/20 0.54
SMN1; SMN2 Q16637 7/20 0.53
GAA P10253 5/20 0.53
CDC7 O00311 1/20 0.51
ALDH1A1 P00352 8/20 0.49
NOX4 Q9NPH5 1/20 0.46
NOX1 Q9Y5S8 1/20 0.46
RECQL P46063 1/20 0.46
TDP1 Q9NUW8 4/20 0.45
HPGD P15428 4/20 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
SCHEMBL11755279 0.92 MAPT (0.65) MAPTKDM4EKMT2AMEN1LMNA
SCHEMBL23400761 0.92 MAPT (0.57) MAPTKDM4EKMT2AMEN1LMNA
SCHEMBL23399462 0.85 KMT2A (0.51) MAPTKDM4EKMT2AMEN1LMNA
SCHEMBL23400828 0.85 ALKBH5 (0.57) MAPTKDM4EKMT2AMEN1LMNA
SCHEMBL6521597 0.82 ALKBH5 (0.57) MAPTKDM4EKMT2AMEN1LMNA
SCHEMBL486125 0.79 MAPT (0.73) MAPTKDM4EKMT2AMEN1LMNA
SCHEMBL23399796 0.79 NOX4 (0.48) MAPTKDM4EKMT2AMEN1LMNA
SCHEMBL23400365 0.79 MAPT (0.46) MAPTKDM4EKMT2AMEN1LMNA
SCHEMBL23402953 0.78 KDM4E (0.49) MAPTKDM4EKMT2AMEN1LMNA
SCHEMBL2085581 0.78 MAPT (0.69) MAPTKDM4EKMT2AMEN1LMNA

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-3828159-A1 STORAGE AND TRANSPORT STABILIZERS FOR POLYMERIZABLE COMPOUNDS BASF SE (DE) 2021-06-02 EP disclosed