SCHEMBL8073301

SCHEMBL8073301

CCCCCCCCC(N)C(O)O

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 2/20 0.59
SPHK1 Q9NYA1 2/20 0.59
LMNA P02545 2/20 0.59
TP53 P04637 2/20 0.59
GMNN O75496 1/20 0.59
POLB P06746 1/20 0.59
THPO P40225 1/20 0.59
MTOR P42345 1/20 0.59
BLM P54132 1/20 0.59
KDM4E B2RXH2 1/20 0.59
CYP1A2 P05177 1/20 0.59
CYP3A4 P08684 1/20 0.59
MAPT P10636 1/20 0.59
CETP P11597 1/20 0.59
HTT P42858 1/20 0.59
UBE2N P61088 1/20 0.59
OPRM1 P35372 1/20 0.50
LAP3 P28838 2/20 0.48
GPR84 Q9NQS5 3/20 0.46
FFAR1 O14842 1/20 0.46

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
SCHEMBL25801408 1.00 CYP2D6 (0.59) CYP2D6SPHK1LMNATP53GMNN
SCHEMBL8647773 1.00 CYP2D6 (0.59) CYP2D6SPHK1LMNATP53GMNN
SCHEMBL7695736 1.00 CYP2D6 (0.59) CYP2D6SPHK1LMNATP53GMNN
SCHEMBL8358182 1.00 CYP2D6 (0.59) CYP2D6SPHK1LMNATP53GMNN
SCHEMBL9575961 1.00 CYP2D6 (0.59) CYP2D6SPHK1LMNATP53GMNN
SCHEMBL7552073 1.00 CYP2D6 (0.59) CYP2D6SPHK1LMNATP53GMNN
Hydrochloric Acid SCHEMBL10943130 0.98 CYP2D6 (0.57) CYP2D6SPHK1LMNATP53GMNN
Bromide SCHEMBL9575769 0.98 CYP2D6 (0.57) CYP2D6SPHK1LMNATP53GMNN
Hydrochloric Acid SCHEMBL3396171 0.98 CYP2D6 (0.57) CYP2D6SPHK1LMNATP53GMNN
Hydrochloric Acid SCHEMBL2383481 0.98 CYP2D6 (0.57) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6039766-A Cleaning process for dry cleaning NICCA CHEMICAL CO., LTD. (JP) 2000-03-21 US disclosed