SCHEMBL10645650

SCHEMBL10645650

C=CCC1CCCCC1OC(=O)C(=C)C

nearest known ligand 0.39

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.34
MEN1 O00255 3/20 0.34
KMT2A Q03164 3/20 0.34
APOBEC3A P31941 1/20 0.32
APOBEC3G Q9HC16 1/20 0.32
IDO1 P14902 1/20 0.30
TDO2 P48775 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
SCHEMBL1961330 0.82 ALDH1A1 (0.35) ALDH1A1MEN1KMT2AAPOBEC3AAPOBEC3G
SCHEMBL733116 0.79 ALDH1A1 (0.42) ALDH1A1KMT2A
SCHEMBL2220151 0.79 ALDH1A1 (0.35) ALDH1A1MEN1KMT2AAPOBEC3AAPOBEC3G
SCHEMBL1943794 0.78 ALDH1A1 (0.38) ALDH1A1MEN1KMT2AAPOBEC3AAPOBEC3G
SCHEMBL27615454 0.77 MEN1 (0.34) ALDH1A1MEN1KMT2AAPOBEC3AAPOBEC3G
SCHEMBL8626000 0.77 ALDH1A1 (0.41) ALDH1A1MEN1KMT2A
SCHEMBL23493969 0.76 CA1 (0.38) ALDH1A1MEN1KMT2AAPOBEC3AAPOBEC3G
SCHEMBL29236071 0.76 MEN1 (0.35) ALDH1A1MEN1KMT2A
SCHEMBL31184214 0.76 TSHR (0.41) ALDH1A1MEN1KMT2A
SCHEMBL8222151 0.76 MEN1 (0.36) ALDH1A1MEN1KMT2A

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-4725629-A Process of making an interpenetrating superabsorbent polyurethane foam KIMBERLY-CLARK CORPORATION (US) 1988-02-16 US disclosed