SCHEMBL16639211

SCHEMBL16639211

Cc1cc(Br)cc(C(=O)NC(C)I)c1NC(=O)c1cc(C(F)(F)F)nn1-c1ncccc1Cl

nearest known ligand 0.55

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
DHODH Q02127 2/20 0.35
PDE4B Q07343 3/20 0.34
CARM1 Q86X55 1/20 0.33
TRPV1 Q8NER1 1/20 0.33
KDM4E B2RXH2 1/20 0.33
MEN1 O00255 1/20 0.33
ALDH1A1 P00352 1/20 0.33
MAPT P10636 1/20 0.33
KMT2A Q03164 1/20 0.33
F10 P00742 2/20 0.33
F2 P00734 1/20 0.33
OPRL1 P41146 1/20 0.33
STIM1 Q13586 1/20 0.33
ORAI1 Q96D31 1/20 0.33
KLKB1 P03952 3/20 0.32

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
SCHEMBL782481 0.94 DHODH (0.36) DHODHPDE4BCARM1TRPV1KDM4E
SCHEMBL16622508 0.93 PDE4B (0.35) DHODHPDE4BCARM1TRPV1KDM4E
SCHEMBL15693449 0.92 PDE4B (0.35) PDE4BCARM1TRPV1KDM4EMEN1
SCHEMBL16622523 0.91 PDE4B (0.35) DHODHPDE4BCARM1TRPV1KDM4E
SCHEMBL16622519 0.90 DHODH (0.38) DHODHPDE4BCARM1TRPV1KDM4E
SCHEMBL16639217 0.90 DHODH (0.42) DHODHMAPTF10
SCHEMBL782214 0.90 CARM1 (0.38) DHODHPDE4BCARM1TRPV1KDM4E
SCHEMBL15244619 0.89 PDE4B (0.40) DHODHPDE4BCARM1TRPV1KDM4E
SCHEMBL16622516 0.88 KDM4E (0.37) DHODHPDE4BTRPV1KDM4EMEN1
SCHEMBL10028765 0.88 DHODH (0.36) DHODHPDE4BTRPV1KDM4EMEN1

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-1699290-B2 INSECTICIDAL ACTIVE SUBSTANCE COMBINATIONS CONTAINING ANTHRANILIC ACID AMIDES AND AT LEAST ONE OTHER INSECTICIDE BAYER CROPSCIENCE AG (DE) 2015-04-15 EP disclosed