SCHEMBL29120290

SCHEMBL29120290

CCS(=O)(=O)CC(=O)c1ccc(OC(F)(F)C(F)C(F)F)cn1

nearest known ligand 0.33

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ MAPK7 Q13164 1/20 0.32
▸ LNPEP Q9UIQ6 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ TSHR P16473 1/20 0.31
▸ HSD17B10 Q99714 1/20 0.31
▸ USP30 Q70CQ3 1/20 0.31
▸ GRIN1 Q05586 2/20 0.31
▸ GRIN2B Q13224 2/20 0.31
▸ P4HTM Q9NXG6 2/20 0.31
▸ CSF1R P07333 2/20 0.30
▸ FLT3 P36888 2/20 0.30
▸ POLB P06746 1/20 0.30
▸ NR3C1 P04150 1/20 0.30
▸ MCHR1 Q99705 2/20 0.30
▸ PDGFRB P09619 1/20 0.30
▸ KIT P10721 1/20 0.30
▸ PDGFRA P16234 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
SCHEMBL17992189 0.80 KMT2A (0.41) MEN1KMT2AALDH1A1TSHRP4HTM
SCHEMBL19767100 0.78 ACACB (0.37) P4HTM
SCHEMBL17992230 0.77 BACE1 (0.38) TSHRP4HTM
SCHEMBL30405431 0.74 ACACB (0.34) P4HTM
SCHEMBL20601596 0.74 ACACB (0.34) P4HTM
SCHEMBL21982064 0.72 P4HTM (0.32) P4HTM
SCHEMBL17987946 0.71 APLNR (0.40) MEN1KMT2AALDH1A1TSHRP4HTM
SCHEMBL17992259 0.69 MAOB (0.45) TSHR
SCHEMBL17520868 0.69 P4HTM (0.49) MEN1KMT2AALDH1A1TSHRHSD17B10
SCHEMBL17992227 0.69 ALDH1A1 (0.51) MEN1KMT2AALDH1A1TSHR

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
CN-111918865-B Heterocyclic compound and harmful arthropod control composition containing same 住友化学株式会社 2023-10-27 — — CN disclosed
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