SCHEMBL22503281

SCHEMBL22503281

COCOC(=O)C1CCCCC1C(=O)NS(=O)(=O)C(F)(F)F

nearest known ligand 0.38

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.38
TP53 P04637 2/20 0.38
GAA P10253 1/20 0.38
CYP2D6 P10635 1/20 0.38
CYP2C19 P33261 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.34
CYP3A4 P08684 1/20 0.34
MAPT P10636 1/20 0.34

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
SCHEMBL22503283 0.86 SLC6A2 (0.37) ALDH1A1TP53GAACYP2D6CYP2C19
SCHEMBL22503215 0.80 TP53 (0.62) ALDH1A1TP53GAACYP2D6CYP2C19
SCHEMBL22503201 0.78 ALDH1A1 (0.37) ALDH1A1TP53GAACYP2D6CYP2C19
SCHEMBL18785344 0.77 TP53 (0.36) ALDH1A1TP53GAACYP2D6CYP2C19
SCHEMBL24452524 0.77 ALDH1A1 (0.38) ALDH1A1TP53GAACYP2D6CYP2C19
SCHEMBL26163086 0.75 ALDH1A1 (0.31) ALDH1A1TP53GAACYP2D6CYP2C19
SCHEMBL26163050 0.75 ALDH1A1 (0.44) ALDH1A1GAAL3MBTL1MAPT
SCHEMBL22503286 0.75 ALDH1A1 (0.34) ALDH1A1TP53GAACYP2D6CYP2C19
SCHEMBL26163087 0.74 ALDH1A1 (0.31) ALDH1A1TP53GAACYP2D6CYP2C19
SCHEMBL18785634 0.72 TP53 (0.33) ALDH1A1TP53CYP3A4

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 3 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-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