SCHEMBL27965641

SCHEMBL27965641

O=C(O)c1cc(-c2ncccc2-c2ncccc2Cl)n[nH]1

nearest known ligand 0.64

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALPL P05186 11/20 0.64
PIN1 Q13526 1/20 0.55
CA12 O43570 4/20 0.49
TP53 P04637 1/20 0.49
MARS1 P56192 1/20 0.48
KDM4E B2RXH2 1/20 0.45
MAPT P10636 1/20 0.45
HTT P42858 1/20 0.45
CA9 Q16790 2/20 0.43
RPA1 P27694 1/20 0.43
ALOX15 P16050 1/20 0.42
HPGDS O60760 1/20 0.41

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
SCHEMBL27635797 0.92 ALPL (0.62) ALPLPIN1CA12TP53MARS1
SCHEMBL27951101 0.81 ALPL (0.48) ALPLPIN1CA12TP53MARS1
SCHEMBL27757070 0.80 PLA2G10 (0.48) ALPLPIN1CA12TP53KDM4E
SCHEMBL643640 0.79 ALPL (1.00) ALPLPIN1CA12TP53MARS1
SCHEMBL28061616 0.78 ALPL (0.44) ALPLPIN1CA12TP53MARS1
SCHEMBL28061601 0.76 ALPL (0.47) ALPLPIN1CA12TP53KDM4E
SCHEMBL28061618 0.73 POLB (0.51) ALPLPIN1CA12CA9HPGDS
SCHEMBL28468318 0.72 KDM4E (0.50) KDM4EMAPTALOX15
SCHEMBL28810671 0.72 JAK2 (0.43) ALPLPIN1KDM4EMAPT
SCHEMBL1813677 0.71 PIN1 (1.00) ALPLPIN1CA12TP53KDM4E

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-103058993-B Chlorantraniliprole preparation method UNIV HENAN NORMAL 2014-06-04 CN claimed
CN-103058993-B Chlorantraniliprole preparation method UNIV HENAN NORMAL 2014-06-04 CN disclosed