SCHEMBL19856906

SCHEMBL19856906

CC(C)(C)C(NC(=O)c1cc2ccccc2[nH]1)C(=O)N1CC2CC1CN2C(=O)CNC(=O)O

nearest known ligand 0.45

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 2/20 0.45
CYP51A1 Q16850 1/20 0.43
STAT6 P42226 1/20 0.40
PYGL P06737 1/20 0.40
CCKBR P32239 3/20 0.40
TAS1R3 Q7RTX0 1/20 0.39
TAS1R1 Q7RTX1 1/20 0.39
DRD3 P35462 1/20 0.39
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 1/20 0.39
GAA P10253 1/20 0.39
MAPK1 P28482 1/20 0.39

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
SCHEMBL14964347 0.88 DRD2 (0.47) DRD2CYP51A1STAT6PYGLCCKBR
SCHEMBL4053233 0.88 STAT6 (0.40) DRD2CYP51A1STAT6TAS1R3TAS1R1
SCHEMBL1931683 0.86 DRD2 (0.47) DRD2CYP51A1STAT6PYGLTAS1R3
SCHEMBL1931303 0.86 DRD2 (0.47) DRD2CYP51A1STAT6PYGLTAS1R3
SCHEMBL1931738 0.86 DRD2 (0.47) DRD2CYP51A1STAT6PYGLTAS1R3
SCHEMBL19856892 0.86 DRD2 (0.45) DRD2CYP51A1STAT6PYGLCCKBR
SCHEMBL19856894 0.86 DRD2 (0.45) DRD2CYP51A1STAT6PYGLCCKBR
SCHEMBL19856934 0.85 STAT6 (0.43) DRD2CYP51A1STAT6PYGLCCKBR
SCHEMBL1549547 0.84 PDGFRB (0.46) DRD2CYP51A1STAT6PYGL
SCHEMBL4050835 0.84 DRD2 (0.39) DRD2CYP51A1STAT6PYGLCCKBR

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
EP-2925857-B1 USE OF TRPV4 ANTAGONISTS TO AMELIORATE HYDROCEPHALUS AND RELATED MATERIALS AND METHODS UNIV INDIANA RES & TECH CORP (US) 2018-02-14 EP claimed