SCHEMBL27734895

SCHEMBL27734895

c1cc(Cc2noc(C3CCNCC3)n2)ccn1

nearest known ligand 0.45

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
NMT1 P30419 8/20 0.45
NR1H4 Q96RI1 1/20 0.43
CYP1A2 P05177 1/20 0.43
CYP3A4 P08684 1/20 0.43
CYP2D6 P10635 1/20 0.43
CYP2C9 P11712 1/20 0.43
CYP2C19 P33261 1/20 0.43
PLAT P00750 6/20 0.40

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
SCHEMBL3868513 0.87 NMT1 (0.55) NMT1NR1H4PLAT
Hydrochloric Acid SCHEMBL3597129 0.86 NMT1 (0.54) NMT1NR1H4PLAT
SCHEMBL27755012 0.86 CYP2C19 (0.58) CYP1A2CYP3A4CYP2D6CYP2C9CYP2C19
SCHEMBL5634822 0.85 PLAT (0.52) NMT1NR1H4PLAT
SCHEMBL3525267 0.84 PPARA (0.45) NMT1NR1H4PLAT
SCHEMBL13547434 0.82 PLAT (0.41) NMT1NR1H4PLAT
SCHEMBL3530200 0.82 NMT1 (0.51) NMT1NR1H4
Hydrochloric Acid SCHEMBL3601850 0.81 PLAT (0.41) NMT1NR1H4PLAT
SCHEMBL3595132 0.80 PLAT (0.43) NMT1NR1H4PLAT
SCHEMBL13543048 0.80 PLAT (0.41) NMT1NR1H4PLAT

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
CN-101420941-A Use of GPR119 receptor agonists for increasing bone mass and for treating osteoporosis, and related combination therapies ARENA PHARM INC (US) 2009-04-29 CN disclosed
CN-101332303-A Combination therapy for the treatment of diabetes and conditions related thereto and for the treatment of conditions ameliorated by increasing a blood glp-1 level ARENA PHARM INC (US) 2008-12-31 CN disclosed