SCHEMBL21268356

SCHEMBL21268356

NC(=O)c1c[c]cc(OC(F)F)c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALOX15 P16050 1/20 0.38
▸ GFER P55789 1/20 0.38
▸ ADAM17 P78536 1/20 0.38
▸ PARP10 Q53GL7 4/20 0.36
▸ KMT2A Q03164 4/20 0.35
▸ MAPT P10636 3/20 0.35
▸ NPSR1 Q6W5P4 3/20 0.35
▸ MEN1 O00255 2/20 0.35
▸ LMNA P02545 1/20 0.35
▸ RAB9A P51151 1/20 0.35
▸ SENP8 Q96LD8 1/20 0.35
▸ SENP7 Q9BQF6 1/20 0.35
▸ SENP6 Q9GZR1 1/20 0.35
▸ KDM4E B2RXH2 1/20 0.35
▸ PARP1 P09874 1/20 0.35
▸ L3MBTL1 Q9Y468 1/20 0.35
▸ GRM2 Q14416 1/20 0.35
▸ KDR P35968 1/20 0.34
▸ ATM Q13315 2/20 0.34
▸ PARP15 Q460N3 3/20 0.33

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
SCHEMBL21268229 0.84 MRGPRX4 (0.42) ALOX15GFERADAM17KMT2AMAPT
SCHEMBL21268378 0.80 GFER (0.39) ALOX15GFERADAM17KMT2AMAPT
SCHEMBL23224123 0.80 F2 (0.44) ALOX15GFERADAM17PARP10KMT2A
SCHEMBL900768 0.77 DRD1 (0.33) ALOX15GFERADAM17KMT2AMAPT
SCHEMBL2232322 0.77 PARP1 (0.55) PARP10KMT2APARP1PARP15PARP14
SCHEMBL21268167 0.76 SLC6A2 (0.40) PARP10KMT2AMAPTKDM4EPARP1
SCHEMBL2762181 0.75 PARP1 (0.62) PARP10KMT2AMAPTNPSR1MEN1
SCHEMBL21268294 0.75 PARP10 (0.40) PARP10KMT2ALMNAPARP1PARP15
SCHEMBL1570178 0.74 PARP1 (0.42) PARP10KMT2AMAPTPARP1L3MBTL1
SCHEMBL1569898 0.74 ALDH1A1 (0.40) PARP10KMT2AMEN1RAB9AKDM4E

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
EP-2900645-B1 HERBICIDAL AND FUNGICIDAL 3-PHENYLISOXAZOLIN DERIVATIVES BAYER CROPSCIENCE AG (DE) 2019-08-21 — — EP disclosed
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