SCHEMBL22503291

SCHEMBL22503291

O=C(NS(=O)(=O)C(F)(F)F)c1ccc2ccc3ccccc3c2c1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 1/20 0.45
PIN1 Q13526 1/20 0.44
SCN5A Q14524 1/20 0.44
SCN9A Q15858 1/20 0.44
PTPN1 P18031 3/20 0.43
VCP P55072 1/20 0.43
ALDH1A1 P00352 2/20 0.42
TP53 P04637 1/20 0.42
CYP1A2 P05177 1/20 0.42
CYP2D6 P10635 1/20 0.42
RAD52 P43351 1/20 0.42
HIF1A Q16665 1/20 0.42
MAPT P10636 2/20 0.42
HPGD P15428 2/20 0.42
KCNJ11 Q14654 2/20 0.42
PTGFR P43088 1/20 0.42
CASP3 P42574 1/20 0.41
GFER P55789 1/20 0.41
SENP8 Q96LD8 1/20 0.41
SENP7 Q9BQF6 1/20 0.41

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
SCHEMBL10362071 0.78 HDAC8 (0.58) ALDH1A1MAPTHPGDCASP3GFER
SCHEMBL22503161 0.78 MMP3 (0.56) MCL1PIN1ALDH1A1HPGDMEN1
SCHEMBL22503259 0.78 KMT2A (0.47) MCL1PIN1SCN5ASCN9APTPN1
SCHEMBL22503295 0.77 MEN1 (0.49) MCL1PIN1SCN5ASCN9APTPN1
SCHEMBL178335 0.76 HDAC3 (0.52) SCN5ASCN9APTPN1VCPMAPT
SCHEMBL22503293 0.75 TTR (0.53) SCN5ASCN9AALDH1A1MAPTHPGD
SCHEMBL22503084 0.74 CTDSP1 (0.53) MCL1SCN5ASCN9APTPN1VCP
SCHEMBL22503305 0.74 CES2 (0.48) SCN5ASCN9APTGFR
SCHEMBL28759623 0.74 MCL1 (0.41) MCL1PIN1KCNJ11CCR2KDM4E
SCHEMBL28995902 0.74 MCL1 (0.43) MCL1PIN1SCN9AKCNJ11CCR2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230161252-A1 POSITIVE RESIST COMPOSITION AND PATTERN FORMING PROCESS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2023-05-25 US disclosed
US-10792489-B2 Bio-electrode composition, bio-electrode, and method for manufacturing the bio-electrode SHIN-ETSU CHEMICAL CO., LTD. (JP) 2020-10-06 US disclosed