SCHEMBL27714729

SCHEMBL27714729

O=C(O)c1cc(-c2ccc(F)cc2)n(-c2ccccc2)n1

nearest known ligand 0.89

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.89
MEN1 O00255 2/20 0.89
RPA1 P27694 5/20 0.80
ATM Q13315 1/20 0.78
L3MBTL1 Q9Y468 1/20 0.74
PPP1CA P62136 3/20 0.70
SMN1; SMN2 Q16637 1/20 0.65
MDM2 Q00987 4/20 0.64
MCL1 Q07820 3/20 0.64
BCL2 P10415 2/20 0.64
MARS1 P56192 2/20 0.63

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
SCHEMBL1514409 0.94 KMT2A (1.00) KMT2AMEN1RPA1ATML3MBTL1
SCHEMBL695352 0.89 RPA1 (1.00) KMT2AMEN1RPA1L3MBTL1PPP1CA
SCHEMBL27694888 0.89 KMT2A (0.71) KMT2AMEN1RPA1ATML3MBTL1
SCHEMBL4493013 0.87 KMT2A (1.00) KMT2AMEN1RPA1ATML3MBTL1
SCHEMBL9207808 0.87 KMT2A (0.78) KMT2AMEN1RPA1ATML3MBTL1
SCHEMBL27422557 0.87 KMT2A (0.78) KMT2AMEN1RPA1ATML3MBTL1
SCHEMBL4500796 0.85 L3MBTL1 (1.00) KMT2AMEN1RPA1ATML3MBTL1
SCHEMBL27524809 0.85 KMT2A (0.74) KMT2AMEN1RPA1ATML3MBTL1
SCHEMBL27694774 0.85 KMT2A (0.69) KMT2AMEN1RPA1ATML3MBTL1
SCHEMBL1764890 0.85 KMT2A (0.82) KMT2AMEN1RPA1ATML3MBTL1

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
CN-101062916-B Three-substituted 1H-pyrromonazole compound, preparation method, medicament composition and pharmacy use thereof INST PHARM & TOXICOLOGY AMMS 2012-12-26 CN disclosed
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