SCHEMBL26622112

SCHEMBL26622112

[CH2]OC(=O)N(OCF)c1ccccc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
NPSR1 Q6W5P4 3/20 0.35
ALDH1A1 P00352 3/20 0.34
KMT2A Q03164 3/20 0.34
NPC1 O15118 2/20 0.34
RAB9A P51151 2/20 0.34
HTT P42858 2/20 0.34
POLB P06746 1/20 0.34
GLA P06280 1/20 0.34
TSHR P16473 1/20 0.34
MTNR1A P48039 2/20 0.33
MTNR1B P49286 2/20 0.33
CHRNB2 P17787 1/20 0.32
CHRNB4 P30926 1/20 0.32
CHRNA3 P32297 1/20 0.32
CHRNA4 P43681 1/20 0.32
MEN1 O00255 2/20 0.32
SMN1; SMN2 Q16637 2/20 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
SCHEMBL28643941 0.79 NPSR1 (0.38) ATMTDP1L3MBTL1NPSR1ALDH1A1
SCHEMBL6003620 0.78 TSHR (0.41) TDP1L3MBTL1ALDH1A1KMT2ANPC1
SCHEMBL6002761 0.75 TSHR (0.44) TDP1ALDH1A1KMT2ANPC1RAB9A
SCHEMBL6002357 0.75 TSHR (0.44) TDP1ALDH1A1KMT2ANPC1RAB9A
SCHEMBL6002262 0.75 TSHR (0.44) TDP1ALDH1A1KMT2ANPC1RAB9A
SCHEMBL6002286 0.71 L3MBTL1 (0.61) ATMTDP1L3MBTL1NPSR1ALDH1A1
SCHEMBL6002564 0.71 ATM (0.33) ATMTDP1L3MBTL1NPSR1KMT2A
SCHEMBL514386 0.68 SMN1; SMN2 (0.53) L3MBTL1NPSR1ALDH1A1KMT2ANPC1
SCHEMBL514163 0.68 TSHR (0.63) ALDH1A1KMT2AHTTGLATSHR
SCHEMBL6003098 0.67 NPC1 (0.57) ALDH1A1KMT2ANPC1RAB9AHTT

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
WO-2023210623-A1 HALOALKYL SULFONE ANILIDE COMPOUND AND HERBICIDE CONTAINING SAME 株式会社エス・ディー・エス バイオテック 2023-11-02 WO disclosed