SCHEMBL25675331

SCHEMBL25675331

Cc1cc2c(F)c(C)c(C)cc2s1

nearest known ligand 0.33

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.33

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
SCHEMBL20126954 0.80 ALDH1A1 (0.36) ALDH1A1
SCHEMBL20146558 0.75 ALDH1A1 (0.33) ALDH1A1
SCHEMBL15281129 0.70 ALDH1A1 (0.39) ALDH1A1
SCHEMBL21983452 0.70 ALDH1A1 (0.35) ALDH1A1
SCHEMBL13021482 0.70 PKM (0.33)
SCHEMBL20022330 0.69 KDM4E (0.36) ALDH1A1
SCHEMBL17345875 0.67 HSD17B10 (0.39) ALDH1A1
SCHEMBL25675332 0.67 HDAC3 (0.33)
SCHEMBL17339827 0.66 PKM (0.32) ALDH1A1
SCHEMBL13271001 0.66 ACHE (0.33)

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-2023109942-A1 COMPOUND-LINKER CONSTRUCTS COMPRISING NOVEL COMPOUNDS USEFUL AS STING AGONISTS AND USES THEREOF JACOBIO PHARMACEUTICALS CO., LTD. (CN) 2023-06-22 WO disclosed