SCHEMBL24780358

SCHEMBL24780358

CC(=O)C1(OCCC(C)C)CCCC1

nearest known ligand 0.44

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.32
CYP19A1 P11511 1/20 0.32
MAPK1 P28482 2/20 0.31
PKM P14618 1/20 0.30
HSD17B10 Q99714 1/20 0.30
TDP1 Q9NUW8 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
SCHEMBL24780364 0.81 TSHR (0.39) ALDH1A1TDP1
SCHEMBL24780370 0.77 NPSR1 (0.31) ALDH1A1
SCHEMBL24780994 0.77 TSHR (0.35) ALDH1A1HSD17B10
SCHEMBL24780355 0.74 TSHR (0.42) ALDH1A1
SCHEMBL25473438 0.74 ALDH1A1 (0.41) ALDH1A1
SCHEMBL24780369 0.74 ALDH1A1 (0.33) ALDH1A1HSD17B10
SCHEMBL5173389 0.72 ALDH1A1 (0.33) ALDH1A1HSD17B10
SCHEMBL7175558 0.71 CYP2C19 (0.33) ALDH1A1
SCHEMBL4778954 0.70 ALDH1A1 (0.33) ALDH1A1
SCHEMBL3661507 0.69 TSHR (0.38) ALDH1A1

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
WO-2023083295-A1 ESTER DERIVATIVES OF N4-HYDROXYCYTIDINE AND USE THEREOF SUZHOU SPRING-SEA BIO-PHARMACEUTICALS CO., LTD. (CN) 2023-05-19 WO disclosed
WO-2022262845-A1 ESTER DERIVATIVES OF N4-HYDROXYCYTIDINE AND USE THEREOF SUZHOU SPRING-SEA BIO-PHARMACEUTICALS CO., LTD. (CN) 2022-12-22 WO disclosed