SCHEMBL9355220

SCHEMBL9355220

CN1CCN(C(=O)O[C@@H](Cc2ccccc2)C(=O)OCc2ccccc2)CC1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 1/20 0.53
CHRM1 P11229 4/20 0.52
TMEM97 Q5BJF2 6/20 0.48
SIGMAR1 Q99720 6/20 0.48
HTR1A P08908 1/20 0.48
ADRA2A P08913 1/20 0.48
ADRA2B P18089 1/20 0.48
ADRA2C P18825 1/20 0.48
DRD1 P21728 1/20 0.48
HRH2 P25021 1/20 0.48
HTR1B P28222 1/20 0.48
HTR2A P28223 1/20 0.48
HTR2C P28335 1/20 0.48
HTR1E P28566 1/20 0.48
SLC6A4 P31645 1/20 0.48
HRH1 P35367 1/20 0.48
HTR2B P41595 1/20 0.48
HRH3 Q9Y5N1 1/20 0.48
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47

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
SCHEMBL9355215 1.00 HSD17B10 (0.53) HSD17B10CHRM1TMEM97SIGMAR1HTR1A
SCHEMBL8681953 0.87 MEN1 (0.49) HRH3MEN1KMT2ANPSR1SMN1; SMN2
SCHEMBL9354940 0.87 MEN1 (0.49) HRH3MEN1KMT2ANPSR1SMN1; SMN2
SCHEMBL9354821 0.87 HSD17B10 (0.58) HSD17B10CHRM1
SCHEMBL7278049 0.87 HSD17B10 (0.58) HSD17B10CHRM1
SCHEMBL9354490 0.87 CYP2C19 (0.45) MEN1KMT2ANPSR1SMN1; SMN2NPC1
SCHEMBL9354485 0.87 CYP2C19 (0.45) MEN1KMT2ANPSR1SMN1; SMN2NPC1
SCHEMBL9354988 0.86 LMNA (0.50) HSD17B10TMEM97SIGMAR1HTR1AADRA2A
SCHEMBL9354980 0.86 LMNA (0.50) HSD17B10TMEM97SIGMAR1HTR1AADRA2A
SCHEMBL7326296 0.85 KMT2A (0.67) HSD17B10MEN1KMT2ANPSR1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0300189-B1 New amino acid derivatives, processes for the preparation thereof and pharmaceutical composition comprising the same FUJISAWA PHARMACEUTICAL CO (JP) 1994-11-02 EP disclosed
US-5223489-A Treatment of ypertension and heart failure UJISAWA PHARMACEUTICAL CO., LTD. (JP) 1993-06-29 US disclosed
US-5142048-A Enzyme inhibitor; carbamoyl group-containing acids FUJISAWA PHARMACEUTICAL COMPANY, LTD. (JP) 1992-08-25 US disclosed
US-4921855-A New Histidyl amino acid derivatives, and pharmaceutical composition comprising the same FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1990-05-01 US disclosed
EP-0300189-A2 New amino acid derivatives, processes for the preparation thereof and pharmaceutical composition comprising the same FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1989-01-25 EP disclosed