SCHEMBL27714746

SCHEMBL27714746

NC(=O)c1cc(-c2ccc(F)cc2)n(-c2ccccc2Cl)n1

nearest known ligand 0.59

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MARS1 P56192 8/20 0.59
KMT2A Q03164 3/20 0.51
MEN1 O00255 2/20 0.51
ATM Q13315 1/20 0.51
PPP1CA P62136 2/20 0.49
RPA1 P27694 2/20 0.49
SCN9A Q15858 1/20 0.46
ALDH1A1 P00352 1/20 0.46
MAPT P10636 1/20 0.46
HTT P42858 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.45
FABP3 P05413 1/20 0.44
FABP4 P15090 1/20 0.44

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
SCHEMBL27714730 0.89 MARS1 (0.74) MARS1KMT2AMEN1ATMPPP1CA
SCHEMBL9207624 0.84 MARS1 (0.49) MARS1KMT2AMEN1PPP1CARPA1
SCHEMBL8317362 0.82 PTGS2 (0.49) MARS1KMT2AMEN1ATMALDH1A1
SCHEMBL27694888 0.82 KMT2A (0.71) MARS1KMT2AMEN1ATMPPP1CA
SCHEMBL27694772 0.81 MEN1 (0.47) MARS1KMT2AMEN1ATMPPP1CA
SCHEMBL1831165 0.79 MARS1 (0.74) MARS1KMT2AMEN1PPP1CARPA1
SCHEMBL27714814 0.78 MARS1 (0.48) MARS1KMT2AMEN1ATMFABP3
SCHEMBL8742241 0.78 RPA1 (0.78) MARS1KMT2AMEN1PPP1CARPA1
SCHEMBL5473862 0.78 RPA1 (0.78) MARS1KMT2AMEN1ATMPPP1CA
SCHEMBL9630621 0.78 MARS1 (0.61) MARS1KMT2AMEN1PPP1CARPA1

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
CN-101062916-A Three-substituted 1H-pyrromonazole compound, preparation method, medicament composition and pharmacy use thereof POISON MED INST PLA MED ACAD (CN) 2007-10-31 CN disclosed