SCHEMBL7901906

SCHEMBL7901906

CCCCCCCCCCCCC(CCCCN)C(=O)O

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CPB2 Q96IY4 4/20 0.63
GRIK1 P39086 2/20 0.62
GRIK2 Q13002 2/20 0.62
SLC1A2 P43004 1/20 0.59
SLC1A1 P43005 1/20 0.59
CA2 P00918 1/20 0.55
MAPK1 P28482 1/20 0.55
GPR84 Q9NQS5 3/20 0.53
FFAR1 O14842 1/20 0.53
DNM1 Q05193 4/20 0.52
MEN1 O00255 1/20 0.52
KMT2A Q03164 1/20 0.52
ALDH1A1 P00352 1/20 0.52
TSHR P16473 1/20 0.52
EPHX1 P07099 1/20 0.52
CHRM1 P11229 1/20 0.52
AKR1A1 P14550 1/20 0.52
CHRM3 P20309 1/20 0.52
HTR2A P28223 1/20 0.52
HTR2C P28335 1/20 0.52

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
SCHEMBL7890323 1.00 CPB2 (0.63) CPB2GRIK1GRIK2SLC1A2SLC1A1
SCHEMBL7890492 1.00 CPB2 (0.63) CPB2GRIK1GRIK2SLC1A2SLC1A1
SCHEMBL7901772 1.00 CPB2 (0.63) CPB2GRIK1GRIK2SLC1A2SLC1A1
SCHEMBL265335 1.00 CPB2 (0.63) CPB2GRIK1GRIK2SLC1A2SLC1A1
SCHEMBL7890496 1.00 CPB2 (0.63) CPB2GRIK1GRIK2SLC1A2SLC1A1
SCHEMBL15208444 1.00 CPB2 (0.63) CPB2GRIK1GRIK2SLC1A2SLC1A1
SCHEMBL15209530 1.00 CPB2 (0.63) CPB2GRIK1GRIK2SLC1A2SLC1A1
SCHEMBL15209173 1.00 CPB2 (0.63) CPB2GRIK1GRIK2SLC1A2SLC1A1
SCHEMBL15208712 1.00 CPB2 (0.63) CPB2GRIK1GRIK2SLC1A2SLC1A1
SCHEMBL15208940 1.00 CPB2 (0.63) CPB2GRIK1GRIK2SLC1A2SLC1A1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6187938-B1 TRANSDERMAL PENETRATION ENHANCERS BOCHEMIE, S.R.O. (CZ) 2001-02-13 US disclosed
EP-0973710-A2 OMEGA-AMINO ACID DERIVATIVES, PROCESSES OF THEIR PREPARATION AND THEIR USE Bochemie S.R.O. (CZ) 2000-01-26 EP disclosed
WO-1998045233-A2 OMEGA-AMINO ACID DERIVATIVES, PROCESSES OF THEIR PREPARATION AND THEIR USE BOCHEMIE S.R.O. (CZ) 1998-10-15 WO disclosed
US-4238350-A ENHANCED OIL RECOVERY, AMINO CARBOXYLIC ACIDS MALACO AG (CH) 1980-12-09 US disclosed