SCHEMBL25913792

SCHEMBL25913792

BCc1c(B)c(C(=O)OCC2CO2)c(C(=O)OCCS(=O)(=O)O)c(CB)c1CB

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 1/20 0.30
▸ TP53 P04637 1/20 0.30
▸ CYP3A4 P08684 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
SCHEMBL25476270 0.94 ALDH1A1 (0.33) ALDH1A1TP53CYP3A4
SCHEMBL25528038 0.93 ALDH1A1 (0.30) ALDH1A1TP53CYP3A4
SCHEMBL25913787 0.81 — —
SCHEMBL25913789 0.81 SMN1; SMN2 (0.33) ALDH1A1CYP3A4
SCHEMBL25913793 0.80 — —
SCHEMBL25913783 0.80 STS (0.30) —
SCHEMBL25913785 0.79 STS (0.32) —
SCHEMBL25737072 0.77 — —
SCHEMBL19756092 0.77 ALDH1A1 (0.35) ALDH1A1TP53CYP3A4
SCHEMBL25913782 0.76 — —

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
US-20230236503-A1 RESIST COMPOSITION AND PATTERN FORMING PROCESS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2023-07-27 — — US disclosed
Send feedback