SCHEMBL8270265

SCHEMBL8270265

COCCC(CC1(C(=O)NCCCc2ccc3c(c2)CCO3)CCCCC1)C(=O)O

nearest known ligand 0.67

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MME P08473 9/20 0.67
CHRM5 P08912 5/20 0.41
CHRM1 P11229 5/20 0.41
MMP1 P03956 2/20 0.40
CHRM4 P08173 2/20 0.39
CHRM3 P20309 2/20 0.39
CHRM2 P08172 1/20 0.39
RAB9A P51151 2/20 0.39
NPC1 O15118 1/20 0.39
POLB P06746 1/20 0.39
TAS1R3 Q7RTX0 1/20 0.37
TAS1R1 Q7RTX1 1/20 0.37

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
SCHEMBL6337481 0.99 MME (0.68) MMECHRM5CHRM1MMP1CHRM4
SCHEMBL6339711 0.99 MME (0.68) MMECHRM5CHRM1MMP1CHRM4
SCHEMBL8270495 0.90 MME (0.54) MMECHRM5CHRM1MMP1CHRM4
SCHEMBL8271281 0.85 MME (0.65) MMEMMP1
SCHEMBL6349761 0.80 MME (1.00) MMEMMP1RAB9ANPC1
SCHEMBL489205 0.80 MME (1.00) MMEMMP1
SCHEMBL6340259 0.80 MME (0.82) MMEMMP1POLB
SCHEMBL1620495 0.80 MME (1.00) MMEMMP1
SCHEMBL8268609 0.79 RAB9A (0.45) MMECHRM5CHRM1CHRM4CHRM3
SCHEMBL8269280 0.76 MME (0.53) MMEMMP1RAB9A

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-2006027680-A1 3-(1-CARBAMOYLCYCLOHEXYL) PROPIONIC ACID DERIVATIVES AS INHIBITORS OF NEUTRAL ENDOPEPTIDASE ENZYME PFIZER LIMITED (GB) 2006-03-16 WO disclosed