SCHEMBL5616499

SCHEMBL5616499

CCCCCCCCCCCCCC=CC(O)C(N)COCCCCCCCCCCCCCC

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 4/20 0.65
▸ KMT2A Q03164 4/20 0.65
▸ CETP P11597 4/20 0.65
▸ SPHK2 Q9NRA0 4/20 0.65
▸ SPHK1 Q9NYA1 4/20 0.65
▸ MAPT P10636 3/20 0.65
▸ GMNN O75496 2/20 0.65
▸ LMNA P02545 2/20 0.65
▸ GLA P06280 2/20 0.65
▸ POLB P06746 2/20 0.65
▸ THRB P10828 2/20 0.65
▸ MAPK1 P28482 2/20 0.65
▸ CXCR5 P32302 2/20 0.65
▸ CCR6 P51684 2/20 0.65
▸ BLM P54132 2/20 0.65
▸ UBE2N P61088 2/20 0.65
▸ CYP2D6 P10635 2/20 0.65
▸ ALDH1A1 P00352 2/20 0.65
▸ TP53 P04637 1/20 0.65
▸ CYP1A2 P05177 1/20 0.65

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
SCHEMBL27705510 1.00 MEN1 (0.65) MEN1KMT2ACETPSPHK2SPHK1
SCHEMBL9112746 1.00 MEN1 (0.65) MEN1KMT2ACETPSPHK2SPHK1
SCHEMBL28772557 1.00 MEN1 (0.65) MEN1KMT2ACETPSPHK2SPHK1
SCHEMBL4608213 1.00 MEN1 (0.65) MEN1KMT2ACETPSPHK2SPHK1
SCHEMBL312332 1.00 MEN1 (0.65) MEN1KMT2ACETPSPHK2SPHK1
SCHEMBL27491463 1.00 MEN1 (0.65) MEN1KMT2ACETPSPHK2SPHK1
SCHEMBL9011612 0.98 MEN1 (0.63) MEN1KMT2ACETPSPHK2SPHK1
SCHEMBL9513991 0.94 S1PR1 (0.59) MEN1KMT2ACETPSPHK2SPHK1
SCHEMBL8531537 0.94 S1PR1 (0.59) MEN1KMT2ACETPSPHK2SPHK1
SCHEMBL13009766 0.89 SPHK2 (0.67) MEN1KMT2ACETPSPHK2SPHK1

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-2007136635-A1 ENHANCEMENT OF RADIATION THERAPY AND/OR CHEMOTHERAPY WITH ACID CERAMIDASE MODULATORS MUSC FOUNDATION FOR RESEARCH DEVELOPMENT (US) 2007-11-29 — — WO disclosed
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