SCHEMBL9099694

SCHEMBL9099694

C1CCC(OC2CCCCO2)OC1.CCC(Cl)CCCCCCCCCO

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31

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
SCHEMBL9099693 0.82 MEN1 (0.43) MEN1KMT2A
SCHEMBL9661524 0.76 MEN1 (0.36) MEN1KMT2A
SCHEMBL10765977 0.75 MEN1 (0.38) MEN1KMT2A
SCHEMBL28323877 0.75 MEN1 (0.38) MEN1KMT2A
SCHEMBL6908302 0.75 MEN1 (0.38) MEN1KMT2A
SCHEMBL8496322 0.74 ALDH1A1 (0.36) MEN1KMT2A
SCHEMBL11347445 0.74 LPAR2 (0.37)
SCHEMBL11345711 0.74
SCHEMBL11012718 0.74 MEN1 (0.36) MEN1KMT2A
SCHEMBL7826832 0.74 ALDH1A1 (0.35) MEN1KMT2A

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-5576012-A Pharmaceutical aqueous formulations containing a sparingly soluble pharmaceutical active compound with a solubilizing polymeric agent BAUER KURT H (DE) 1996-11-19 US disclosed