SCHEMBL8893237

SCHEMBL8893237

CC(=O)OCCCCCC1CCCCC1

nearest known ligand 0.65

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 1/20 0.59
NAAA Q02083 13/20 0.52
SMN1; SMN2 Q16637 1/20 0.50
FKBP1A P62942 1/20 0.49
ASAH1 Q13510 1/20 0.49
LMNA P02545 1/20 0.49
APOBEC3A P31941 1/20 0.49
APOBEC3G Q9HC16 1/20 0.49

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
SCHEMBL10263186 0.98 EPHX1 (0.61) EPHX1NAAASMN1; SMN2FKBP1AASAH1
SCHEMBL6931991 0.93 SMN1; SMN2 (0.56) EPHX1NAAASMN1; SMN2FKBP1A
SCHEMBL19842292 0.93 SMN1; SMN2 (0.56) EPHX1NAAASMN1; SMN2FKBP1A
SCHEMBL23471248 0.91 ALDH1A1 (0.48) EPHX1NAAASMN1; SMN2FKBP1ALMNA
SCHEMBL11696307 0.91 ALDH1A1 (0.48) EPHX1NAAASMN1; SMN2FKBP1ALMNA
SCHEMBL11693755 0.91 ALDH1A1 (0.48) EPHX1NAAASMN1; SMN2FKBP1ALMNA
SCHEMBL13034075 0.91 SMN1; SMN2 (0.54) EPHX1NAAASMN1; SMN2FKBP1A
SCHEMBL12406393 0.90 EPHX1 (0.53) EPHX1NAAASMN1; SMN2FKBP1AASAH1
SCHEMBL23471057 0.89 ALDH1A1 (0.50) EPHX1NAAASMN1; SMN2FKBP1AASAH1
SCHEMBL8896243 0.85 EPHX1 (0.45) EPHX1NAAASMN1; SMN2LMNAAPOBEC3A

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-5670563-A ORGANOTIN COMPOUND, PHOSPHORUS COMPOUND CIBA-SPECIALTY CHEMICALS CORPORATION (US) 1997-09-23 US disclosed