SCHEMBL6168779

SCHEMBL6168779

O=CN(c1ccc(N2CCCC2)o1)N1CCCCC1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 6/20 0.51
POLB P06746 4/20 0.51
ALDH1A1 P00352 14/20 0.39
MAPT P10636 12/20 0.39
MEN1 O00255 10/20 0.39
KMT2A Q03164 10/20 0.39
RAB9A P51151 6/20 0.39
NPC1 O15118 5/20 0.39
CYP1A2 P05177 2/20 0.39
CYP2C9 P11712 2/20 0.39
CYP2C19 P33261 2/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2D6 P10635 1/20 0.39
THRB P10828 1/20 0.39
LMNA P02545 3/20 0.38
USP2 O75604 1/20 0.38
GAA P10253 1/20 0.38
IDE P14735 1/20 0.38
GPR35 Q9HC97 1/20 0.38
HPGD P15428 5/20 0.36

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
SCHEMBL6169113 0.79 POLB (0.31) SMN1; SMN2POLB
SCHEMBL6168872 0.78 POLB (0.42) SMN1; SMN2POLBALDH1A1MAPTMEN1
SCHEMBL6169862 0.76
SCHEMBL6169230 0.74 POLB (0.47) SMN1; SMN2POLBALDH1A1MAPTMEN1
SCHEMBL1958677 0.70 SMN1; SMN2 (0.96) SMN1; SMN2POLBALDH1A1MAPTMEN1
SCHEMBL6206185 0.70 ALDH1A1 (0.33) POLBALDH1A1MAPTCYP1A2CYP2C9
SCHEMBL6169495 0.69 POLB (0.42) SMN1; SMN2POLBALDH1A1MAPTMEN1
SCHEMBL6167566 0.69 SMN1; SMN2 (0.42) SMN1; SMN2POLBALDH1A1MAPTMEN1
SCHEMBL6167761 0.69 POLB (0.42) SMN1; SMN2POLBALDH1A1MAPTMEN1
SCHEMBL6168118 0.68 POLB (0.41) SMN1; SMN2POLBALDH1A1MAPTMEN1

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
EP-1498109-A1 Furan derivatives and dyeing composition comprising a furan derivative as coupler L'OREAL (FR) 2005-01-19 EP disclosed