SCHEMBL15905591

SCHEMBL15905591

Cc1cc(C#N)cc(C(=O)NC2CCS(=O)(=O)C2)c1NC(=O)c1cc(Cn2nnc(C(F)(F)F)n2)nn1-c1ccccc1Cl

nearest known ligand 0.38

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ELANE P08246 2/20 0.38
GLA P06280 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
DGAT2 Q96PD7 12/20 0.35
LMNA P02545 2/20 0.34
TNF P01375 1/20 0.32
IRAK4 Q9NWZ3 1/20 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
SCHEMBL10089983 0.93 ELANE (0.39) ELANEGLASMN1; SMN2DGAT2LMNA
SCHEMBL13085376 0.93 CNR1 (0.37) ELANE
SCHEMBL317728 0.92 ELANE (0.37) ELANEGLASMN1; SMN2DGAT2LMNA
SCHEMBL10089947 0.91 CNR1 (0.38)
SCHEMBL10089920 0.91 SMN1; SMN2 (0.36) GLASMN1; SMN2DGAT2LMNA
SCHEMBL10089919 0.91 ELANE (0.36) ELANE
SCHEMBL10089889 0.90 CNR1 (0.34)
SCHEMBL10089843 0.90 RORC (0.39) ELANE
SCHEMBL10089952 0.90 SLC2A1 (0.34)
SCHEMBL10089988 0.89 MAPK14 (0.33) DGAT2

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
US-8791143-B2 Anthranilic diamide derivatives having cyclic side-chains BAYER CROPSCIENCE AG (DE) 2014-07-29 US disclosed