SCHEMBL1742836

SCHEMBL1742836

O=C(O)CNC1CCc2ccccc2C1

nearest known ligand 0.62

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GRIN2B Q13224 6/20 0.62
MTNR1A P48039 4/20 0.58
MTNR1B P49286 4/20 0.58
MAOA P21397 1/20 0.56
MAOB P27338 1/20 0.56
SIGMAR1 Q99720 2/20 0.56
CA1 P00915 1/20 0.50
CA2 P00918 1/20 0.50
PRMT5 O14744 1/20 0.49
KMT2A Q03164 2/20 0.48
KDM4E B2RXH2 1/20 0.48
MEN1 O00255 1/20 0.48
GMNN O75496 1/20 0.48
LMNA P02545 1/20 0.48
PMP22 Q01453 1/20 0.48
DPP4 P27487 1/20 0.47
POLB P06746 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
SCHEMBL29434614 0.88 GRIN2B (0.53) GRIN2BMTNR1AMTNR1BSIGMAR1PRMT5
SCHEMBL255286 0.88 GRIN2B (0.53) GRIN2BMTNR1AMTNR1BSIGMAR1PRMT5
Bicarbonate SCHEMBL2441660 0.86 GRIN2B (0.51) GRIN2BMTNR1AMTNR1BSIGMAR1PRMT5
Hydrochloric Acid SCHEMBL10493696 0.86 GRIN2B (0.51) GRIN2BMTNR1AMTNR1BSIGMAR1PRMT5
Bromide SCHEMBL9725911 0.86 GRIN2B (0.51) GRIN2BMTNR1AMTNR1BSIGMAR1PRMT5
SCHEMBL12656430 0.86 GRIN2B (0.56) GRIN2BMTNR1AMTNR1BMAOAMAOB
Glycine SCHEMBL2438253 0.82 GRIN2B (0.47) GRIN2BMTNR1AMTNR1BSIGMAR1CA1
SCHEMBL18983605 0.82 CA1 (0.58) GRIN2BCA1CA2
Hydrochloric Acid SCHEMBL9545036 0.82 MTNR1A (0.56) GRIN2BMTNR1AMTNR1BMAOAMAOB
Hydrochloric Acid SCHEMBL9545040 0.82 MTNR1A (0.56) GRIN2BMTNR1AMTNR1BMAOAMAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2387571-A1 OXADIAZOLE DERIVATIVES AS SLPL RECEPTOR AGONISTS Almirall S.A. (ES) 2011-11-23 EP claimed
US-8041930-B2 Data processing apparatus and method for controlling thread access of register sets when selectively operating in secure and non-secure domains ARM LIMITED (GB) 2011-10-18 US claimed
WO-2010081692-A1 OXADIAZOLE DERIVATIVES AS SLPL RECEPTOR AGONISTS ALMIRALL, S.A. (ES) 2010-07-22 WO claimed
EP-2387571-A1 OXADIAZOLE DERIVATIVES AS SLPL RECEPTOR AGONISTS Almirall S.A. (ES) 2011-11-23 EP disclosed
US-8041930-B2 Data processing apparatus and method for controlling thread access of register sets when selectively operating in secure and non-secure domains ARM LIMITED (GB) 2011-10-18 US disclosed
WO-2010081692-A1 OXADIAZOLE DERIVATIVES AS SLPL RECEPTOR AGONISTS ALMIRALL, S.A. (ES) 2010-07-22 WO disclosed
US-4521607-A HYPOTENSIVE TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1985-06-04 US disclosed
EP-0035868-A1 Bicyclic compounds, their production and use Takeda Chemical Industries, Ltd. (JP) 1981-09-16 EP disclosed