SCHEMBL27604199

SCHEMBL27604199

NP(=O)(O)c1ccc(Oc2ccccc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA9 Q16790 4/20 0.50
MMP2 P08253 3/20 0.50
MMP8 P22894 1/20 0.50
MMP14 P50281 1/20 0.50
CA14 Q9ULX7 1/20 0.50
PARP10 Q53GL7 1/20 0.50
LTA4H P09960 4/20 0.48
NR1H2 P55055 1/20 0.48
BAX Q07812 1/20 0.48
MAOA P21397 1/20 0.48
TSHR P16473 1/20 0.48
SRC P12931 1/20 0.47
CA1 P00915 4/20 0.46
CA2 P00918 4/20 0.46
SOS1 Q07889 1/20 0.46
PGR P06401 1/20 0.44
SRD5A2 P31213 1/20 0.44
CA12 O43570 2/20 0.44
CYP2C9 P11712 1/20 0.42
CYP2C19 P33261 1/20 0.42

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
SCHEMBL2173776 0.83 CA2 (0.62) CA9MMP2MMP8MMP14CA14
SCHEMBL11050917 0.83 MMP2 (0.53) CA9MMP2MMP8MMP14CA14
SCHEMBL27604193 0.82 MEN1 (0.52) CA9MMP2MMP8MMP14CA14
SCHEMBL443059 0.80 CA2 (0.62) TSHRSRCCA2
Diphenylether SCHEMBL356479 0.80 LTA4H (0.67) CA9MMP2MMP8MMP14CA14
Diphenylether SCHEMBL17801642 0.80 LTA4H (0.67) CA9MMP2MMP8MMP14CA14
SCHEMBL3833973 0.79 LTA4H (0.57) CA9MMP2MMP8MMP14CA14
Ammonia Solution, Strong SCHEMBL10908266 0.78 CA2 (0.59) TSHRSRCCA2
Diphenylether SCHEMBL27662442 0.78 LTA4H (0.63) CA9MMP2MMP8MMP14CA14
Diphenylether SCHEMBL27797017 0.78 LTA4H (0.63) CA9MMP2MMP8MMP14CA14

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-1507450-A Novel cyclo azaphospha hydrocarbons ������ҩ�����޹�˾ 2004-06-23 CN disclosed