SCHEMBL27584580

SCHEMBL27584580

Fc1ccc([CH]Cn2cncn2)cc1

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 11/20 0.50
KMT2A Q03164 1/20 0.44
SMN1; SMN2 Q16637 3/20 0.43
LMNA P02545 2/20 0.42
HSP90AA1 P07900 1/20 0.42
CYP3A4 P08684 1/20 0.42
CYP2C9 P11712 1/20 0.42
CYP11B1 P15538 1/20 0.42
CYP11B2 P19099 1/20 0.42
CYP2C19 P33261 1/20 0.42
ADRA1A P35348 1/20 0.42
CYP51A1 Q16850 1/20 0.42
MAPK1 P28482 1/20 0.39
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 1/20 0.39

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
SCHEMBL6442620 0.82 CYP19A1 (0.55) CYP19A1KMT2ASMN1; SMN2LMNAHSP90AA1
SCHEMBL11013990 0.73 CYP19A1 (0.44) CYP19A1KMT2ASMN1; SMN2LMNAHSP90AA1
SCHEMBL3319920 0.73 CYP19A1 (0.67) CYP19A1KMT2ALMNAHSP90AA1CYP3A4
SCHEMBL10943657 0.71 CYP19A1 (0.49) CYP19A1KMT2ASMN1; SMN2LMNAHSP90AA1
SCHEMBL10958849 0.71 KMT2A (0.65) CYP19A1KMT2ALMNAHSP90AA1CYP3A4
SCHEMBL9532543 0.71 CYP19A1 (0.46) CYP19A1KMT2ASMN1; SMN2LMNAHSP90AA1
SCHEMBL27776608 0.69 CYP19A1 (0.39) CYP19A1KMT2ASMN1; SMN2LMNAHSP90AA1
SCHEMBL8386366 0.69 CYP19A1 (0.54) CYP19A1KMT2ASMN1; SMN2LMNAHSP90AA1
SCHEMBL11013983 0.69 CYP19A1 (0.47) CYP19A1KMT2ASMN1; SMN2LMNAHSP90AA1
SCHEMBL11012580 0.68 CYP19A1 (0.46) CYP19A1KMT2ASMN1; SMN2LMNAHSP90AA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101242739-B Liquid compositions for treating plant propagation materials SYNGENTA PARTICIPATIONS AG 2014-05-14 CN disclosed
CN-101099460-A Method of microencapsulating an agricultural active having a high melting point and uses for such materials MONSANTO TECHNOLOGY LLC (US) 2008-01-09 CN disclosed
CN-100337541-C Method for microencapsulating agrochemical active substances having a high melting point and use of these substances MONSANTO TECHNOLOGY LLC (US) 2007-09-19 CN disclosed
CN-1501771-A Method for microencapsulating agrochemical active substances having a high melting point and use of these substances ������ɽ���� 2004-06-02 CN disclosed