SCHEMBL17397436

SCHEMBL17397436

O=C(C1CCCN1)N1CCCC1c1ncc2cccc-2[nH]1

nearest known ligand 0.49

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ PRCP P42785 9/20 0.49
▸ PARP1 P09874 1/20 0.45
▸ DPP4 P27487 4/20 0.43
▸ DPP8 Q6V1X1 2/20 0.43
▸ HCRTR1 O43613 1/20 0.43
▸ HCRTR2 O43614 1/20 0.43
▸ ANPEP P15144 1/20 0.43
▸ FAP Q12884 1/20 0.43
▸ DPP9 Q86TI2 1/20 0.43
▸ DPP7 Q9UHL4 1/20 0.43

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
SCHEMBL17397380 0.97 PRCP (0.46) PRCPPARP1DPP4DPP8HCRTR1
SCHEMBL17397409 0.87 PARP1 (0.42) PRCPPARP1DPP4DPP8HCRTR1
SCHEMBL3344066 0.76 KCNH2 (0.53) PRCPHCRTR1HCRTR2
SCHEMBL3344057 0.76 KCNH2 (0.53) PRCPHCRTR1HCRTR2
SCHEMBL1745251 0.74 KCNH2 (0.57) PRCPHCRTR1HCRTR2
SCHEMBL1745248 0.74 KCNH2 (0.57) PRCPHCRTR1HCRTR2
SCHEMBL19578392 0.73 PRCP (0.60) PRCPHCRTR1HCRTR2
SCHEMBL18815710 0.72 PRCP (0.72) PRCPHCRTR1HCRTR2
SCHEMBL18815709 0.72 PRCP (0.72) PRCPHCRTR1HCRTR2
SCHEMBL18815797 0.71 PRCP (0.53) PRCPHCRTR1HCRTR2

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
WO-2016003827-A2 FUSED CYCLOALKYL-PYRIMIDINE COMPOUNDS AND USES THEREOF MEDIVATION TECHNOLOGIES, INC. (US) 2016-01-07 — — WO disclosed
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