SCHEMBL7535690

SCHEMBL7535690

CCCCCCCCCCCCc1ccccc1/N=N/c1ccc(N(CCO)CCO)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.41
CYP2D6 P10635 1/20 0.41
CYP2C9 P11712 1/20 0.41
LIPG Q9Y5X9 1/20 0.40
NPC1 O15118 3/20 0.40
RAB9A P51151 3/20 0.40
KMT2A Q03164 3/20 0.40
MAPT P10636 2/20 0.40
PSMD14 O00487 1/20 0.40
MITF O75030 1/20 0.40
MEN1 O00255 2/20 0.35
ALPL P05186 1/20 0.35
ALPI P09923 1/20 0.35
ALPG P10696 1/20 0.35
MYC P01106 1/20 0.35
CNR1 P21554 2/20 0.35
CNR2 P34972 2/20 0.35
ALOX5 P09917 1/20 0.35
PTGS2 P35354 1/20 0.35
LMNA P02545 1/20 0.34

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
SCHEMBL7535692 1.00 CYP3A4 (0.41) CYP3A4CYP2D6CYP2C9LIPGNPC1
SCHEMBL30358241 0.91 CYP3A4 (0.41) CYP3A4CYP2D6CYP2C9LIPGNPC1
SCHEMBL7531368 0.85 MAPT (0.53) CYP3A4CYP2D6CYP2C9LIPGNPC1
SCHEMBL7531369 0.85 MAPT (0.53) CYP3A4CYP2D6CYP2C9LIPGNPC1
SCHEMBL19822973 0.82 CYP3A4 (0.50) CYP3A4CYP2D6CYP2C9LIPGNPC1
SCHEMBL7535694 0.82 CYP3A4 (0.50) CYP3A4CYP2D6CYP2C9LIPGNPC1
SCHEMBL7536122 0.81 MAPT (0.48) CYP3A4CYP2D6CYP2C9LIPGNPC1
SCHEMBL7536123 0.81 MAPT (0.48) CYP3A4CYP2D6CYP2C9LIPGNPC1
SCHEMBL28093073 0.80 LIPG (0.47) CYP3A4CYP2D6CYP2C9LIPGNPC1
SCHEMBL10431204 0.80 LIPG (0.49) CYP3A4CYP2D6CYP2C9LIPGCNR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1097188-B1 USE OF AMINO AZOIC DYES AS MARKERS OF OIL DISTILLATION PRODUCTS SIAC IT ADDITIVI CARBURANTI (IT) 2002-04-10 EP disclosed
US-6339145-B1 ADDING TO OIL DISTILLATION PRODUCTS AN AMINO AZOIC DYE COMPOUND SOCIETA' ITALIANA ADDITIVI PER CARBURANTI S.R.L. (IT) 2002-01-15 US disclosed