SCHEMBL22503286

SCHEMBL22503286

CCC1(OC(=O)C2CCCCC2C(=O)NS(=O)(=O)C(F)(F)F)CCCC1

nearest known ligand 0.34

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.34
TP53 P04637 1/20 0.34
GAA P10253 1/20 0.34
CYP2D6 P10635 1/20 0.34
CYP2C19 P33261 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
SCHEMBL26163086 0.84 ALDH1A1 (0.31) ALDH1A1TP53GAACYP2D6CYP2C19
SCHEMBL26163087 0.83 ALDH1A1 (0.31) ALDH1A1TP53GAACYP2D6CYP2C19
SCHEMBL18195964 0.79
SCHEMBL22503283 0.79 SLC6A2 (0.37) ALDH1A1TP53GAACYP2D6CYP2C19
SCHEMBL2380585 0.79 CYP3A4 (0.36) ALDH1A1TP53CYP2D6CYP2C19
SCHEMBL18785630 0.77 TP53 (0.32) ALDH1A1TP53GAACYP2D6CYP2C19
SCHEMBL22503219 0.75 ALDH1A1 (0.31) ALDH1A1TP53GAACYP2D6CYP2C19
SCHEMBL22503281 0.75 ALDH1A1 (0.38) ALDH1A1TP53GAACYP2D6CYP2C19
SCHEMBL24452524 0.75 ALDH1A1 (0.38) ALDH1A1TP53GAACYP2D6CYP2C19
SCHEMBL21504762 0.74

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