SCHEMBL7675181

SCHEMBL7675181

NCc1ccc(Cc2cn(C(c3ccccc3)(c3ccccc3)c3ccccc3)cn2)cc1

nearest known ligand 0.41

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SIRT2 Q8IXJ6 14/20 0.41
CYP11B1 P15538 1/20 0.37
CYP11B2 P19099 1/20 0.37
KIF11 P52732 1/20 0.37
LOXL2 Q9Y4K0 1/20 0.36
TAAR1 Q96RJ0 1/20 0.36
ENPP2 Q13822 1/20 0.34
MAOB P27338 1/20 0.33

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
SCHEMBL7664217 0.91 SIRT2 (0.42) SIRT2CYP11B1CYP11B2KIF11LOXL2
SCHEMBL7663646 0.89 L3MBTL1 (0.45) SIRT2CYP11B1CYP11B2ENPP2MAOB
SCHEMBL5688738 0.86 SIRT2 (0.46) SIRT2CYP11B1CYP11B2ENPP2
SCHEMBL1924923 0.85 SIRT2 (0.45) SIRT2CYP11B1CYP11B2ENPP2
SCHEMBL7668533 0.84 SIRT2 (0.43) SIRT2CYP11B1CYP11B2
SCHEMBL7666301 0.83 PLA2G10 (0.50) SIRT2KIF11
SCHEMBL2787690 0.82 CYP19A1 (0.40) SIRT2CYP11B1CYP11B2KIF11MAOB
SCHEMBL7673104 0.80 POLB (0.41) SIRT2
SCHEMBL2035093 0.79 SIRT2 (0.49) SIRT2CYP11B1CYP11B2LOXL2TAAR1
SCHEMBL7666260 0.77 SIRT2 (0.43) SIRT2CYP11B1CYP11B2

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-6407132-B1 ANTIHISTAMINES, ANTIALLERGENS, ANTIASTHMATICS, ANTICONVULSANTS, AND ANTIDEPRESSANTS; SKIN RASH TREATMENT JAMES BLACK FOUNDATION LIMITED (GB) 2002-06-18 US disclosed