SCHEMBL5206496

SCHEMBL5206496

NCC1CCN(C2(C(=O)O)CCCC2)CC1

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.40
PLG P00747 1/20 0.40
PLAT P00750 1/20 0.40
NCF1 P14598 1/20 0.38
CYP2D6 P10635 1/20 0.38
CHRM2 P08172 4/20 0.37
CHRM1 P11229 4/20 0.37
CHRM3 P20309 4/20 0.37
KDM1A O60341 1/20 0.32
TPSAB1 Q15661 1/20 0.31
TPSD1 Q9BZJ3 1/20 0.31
TPSG1 Q9NRR2 1/20 0.31
TSHR P16473 2/20 0.31
USP2 O75604 1/20 0.31
ALDH1A1 P00352 1/20 0.31
CYP1A2 P05177 1/20 0.31
BLM P54132 1/20 0.31
CACNA2D1 P54289 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31

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
SCHEMBL3296238 0.77 NCF1 (0.35) LMNAPLGPLATNCF1CHRM2
SCHEMBL3293515 0.76 NCF1 (0.34) NCF1CYP2D6CHRM2CHRM1CHRM3
SCHEMBL5332707 0.75 ALDH1A1 (0.38) KDM1ATSHRALDH1A1
SCHEMBL14858388 0.73 ALDH1A1 (0.40) TSHRALDH1A1
SCHEMBL14061763 0.72 KDM1A (0.35) KDM1ATSHRALDH1A1
SCHEMBL5203542 0.72 DPP4 (0.31)
SCHEMBL3296699 0.72 CYP2C19 (0.41) LMNAPLGPLATNCF1CYP2D6
SCHEMBL5206129 0.71 DPP4 (0.33)
SCHEMBL25435115 0.71 ALDH1A1 (0.38) LMNAKDM1ATSHRALDH1A1
SCHEMBL8262149 0.70 PLG (0.38) LMNAPLGPLATNCF1CYP2D6

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-1758891-A2 BENZIMIDAZOLONE CARBOXYLIC ACID DERIVATIVES Pfizer Japan Inc. (JP) 2007-03-07 EP disclosed
WO-2005123718-A2 BENZIMIDAZOLONE CARBOXYLIC ACID DERIVATIVES PFIZER JAPAN INC. (JP) 2005-12-29 WO disclosed