SCHEMBL11526348

SCHEMBL11526348

CCCCCCCCC(O)C(N)CCC(N)C(O)CCCCCCCC

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 2/20 0.76
SPHK1 Q9NYA1 2/20 0.76
LMNA P02545 2/20 0.76
TP53 P04637 2/20 0.76
GMNN O75496 1/20 0.76
POLB P06746 1/20 0.76
THPO P40225 1/20 0.76
MTOR P42345 1/20 0.76
BLM P54132 1/20 0.76
KDM4E B2RXH2 1/20 0.76
CYP1A2 P05177 1/20 0.76
CYP3A4 P08684 1/20 0.76
MAPT P10636 1/20 0.76
CETP P11597 1/20 0.76
HTT P42858 1/20 0.76
UBE2N P61088 1/20 0.76
CSNK1E P49674 1/20 0.58
TRPV1 Q8NER1 1/20 0.52
TRPA1 O75762 1/20 0.52
OPRM1 P35372 1/20 0.48

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
SCHEMBL11524107 1.00 CYP2D6 (0.76) CYP2D6SPHK1LMNATP53GMNN
SCHEMBL11524277 1.00 CYP2D6 (0.76) CYP2D6SPHK1LMNATP53GMNN
SCHEMBL6118549 0.95 CYP2D6 (0.76) CYP2D6SPHK1LMNATP53GMNN
SCHEMBL6117945 0.95 CYP2D6 (0.76) CYP2D6SPHK1LMNATP53GMNN
SCHEMBL16859679 0.95 CYP2D6 (0.76) CYP2D6SPHK1LMNATP53GMNN
SCHEMBL16104483 0.95 CYP2D6 (0.76) CYP2D6SPHK1LMNATP53GMNN
SCHEMBL6118606 0.95 CYP2D6 (0.76) CYP2D6SPHK1LMNATP53GMNN
SCHEMBL16859677 0.95 CYP2D6 (0.76) CYP2D6SPHK1LMNATP53GMNN
SCHEMBL6118653 0.95 CYP2D6 (0.76) CYP2D6SPHK1LMNATP53GMNN
SCHEMBL16859681 0.95 CYP2D6 (0.76) CYP2D6SPHK1LMNATP53GMNN

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4140860-A BACTERICIDES STERLING DRUG INC. (US) 1979-02-20 US disclosed
US-4119668-A ANTIBACTERIAL AGENTS STERLING DRUG INC. (US) 1978-10-10 US disclosed
US-4085144-A ANTIBACTERIAL STERLING DRUG INC. (US) 1978-04-18 US disclosed
US-4022833-A ANTIBACTERIAL AGENTS STERLING DRUG INC. (US) 1977-05-10 US disclosed