SCHEMBL3401258

SCHEMBL3401258

O=C(O)N1CC(OCCC2CCNCC2)C1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 11/20 0.40
ITGA2B P08514 11/20 0.40
TPSAB1 Q15661 2/20 0.39
TPSD1 Q9BZJ3 2/20 0.39
TPSG1 Q9NRR2 2/20 0.39
F2R P25116 6/20 0.37
GNAI3 P08754 1/20 0.36
GNAO1 P09471 1/20 0.36
GNAI1 P63096 1/20 0.36
PIM1 P11309 1/20 0.35
PIM2 Q9P1W9 1/20 0.35
SLC6A1 P30531 2/20 0.35
GABRA5 P31644 2/20 0.35
GABRB2 P47870 2/20 0.35
SLC6A12 P48065 2/20 0.35
SLC6A11 P48066 2/20 0.35
SLC6A13 Q9NSD5 2/20 0.35
GABRA1 P14867 1/20 0.35
GABRR1 P24046 1/20 0.35
GABRA4 P48169 1/20 0.35

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
SCHEMBL3400129 0.81 NR1H2 (0.49) TPSAB1TPSD1TPSG1
SCHEMBL27137149 0.75 ITGB3 (0.50) ITGB3ITGA2BTPSAB1TPSD1TPSG1
SCHEMBL4470355 0.73 ITGB3 (0.58) ITGB3ITGA2BTPSAB1TPSD1TPSG1
SCHEMBL14993623 0.73 GABRP (0.39) ITGB3ITGA2BTPSAB1TPSD1TPSG1
SCHEMBL30013612 0.73 ITGB3 (0.48) ITGB3ITGA2BTPSAB1TPSD1TPSG1
SCHEMBL27153790 0.73 ITGB3 (0.48) ITGB3ITGA2BTPSAB1TPSD1TPSG1
SCHEMBL23267544 0.72 GBA1 (0.34) ITGB3ITGA2BTPSAB1TPSD1TPSG1
SCHEMBL16415506 0.72 PDK2 (0.38) PIM1
SCHEMBL3362157 0.71 NPC1 (0.42) ITGB3ITGA2BTPSAB1TPSD1TPSG1
SCHEMBL2005065 0.71 IGF2R (0.32)

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-2252613-A1 COMPOUNDS AND COMPOSITIONS AS MODULATORS OF GPR119 ACTIVITY IRM, LLC (BM) 2010-11-24 EP disclosed
WO-2009105717-A1 COMPOUNDS AND COMPOSITIONS AS MODULATORS OF GPR119 ACTIVITY IRM LLC (BM) 2009-08-27 WO disclosed