SCHEMBL11624497

SCHEMBL11624497

NC(=O)Nc1c(C(F)(F)C(O)(F)C(F)(F)F)ccc2c1CCCC2

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.34
SORT1 Q99523 1/20 0.32
KCNJ11 Q14654 3/20 0.32
ABCC9 O60706 2/20 0.32
ABCC8 Q09428 2/20 0.32
KCNJ8 Q15842 2/20 0.32
NLRP3 Q96P20 3/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
CXCR2 P25025 1/20 0.31
METAP2 P50579 2/20 0.31
TSHR P16473 1/20 0.31
ALDH1A1 P00352 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
KDM4E B2RXH2 1/20 0.30
POLB P06746 1/20 0.30
GRIN2D O15399 1/20 0.30
GRIN3B O60391 1/20 0.30
GRIN1 Q05586 1/20 0.30
GRIN2A Q12879 1/20 0.30

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
SCHEMBL11624493 0.88 KCNJ11 (0.38) SORT1KCNJ11ABCC9ABCC8KCNJ8
SCHEMBL11625399 0.85 NLRP3 (0.38) NLRP3
SCHEMBL11628632 0.80 NLRP3 (0.45) KCNJ11NLRP3CXCR2
SCHEMBL11620774 0.76 NOS3 (0.34) MEN1KMT2AALDH1A1SMN1; SMN2KDM4E
SCHEMBL11626905 0.74 KDM4E (0.33) MEN1KMT2AALDH1A1SMN1; SMN2KDM4E
SCHEMBL11625276 0.73 NLRP3 (0.37) NLRP3
SCHEMBL11625397 0.73 NLRP3 (0.40) KCNJ11ABCC9ABCC8KCNJ8NLRP3
SCHEMBL11624010 0.71 NLRP3 (0.38) NLRP3ALDH1A1SMN1; SMN2
SCHEMBL11625273 0.70 NLRP3 (0.39) NLRP3
SCHEMBL25845405 0.69 NLRP3 (0.51) NLRP3ALDH1A1SMN1; SMN2

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-4093742-A Anti-hypertensive polyhaloisopropyl-substituted arylureas SCHERING CORPORATION (US) 1978-06-06 US disclosed