SCHEMBL3911083

SCHEMBL3911083

Cc1cccc(C2(N3CCCC3=O)CCNCC2)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRD O14764 1/20 0.41
GABRA1 P14867 1/20 0.41
GABRB1 P18505 1/20 0.41
GABRA5 P31644 1/20 0.41
GABRA3 P34903 1/20 0.41
GABRA2 P47869 1/20 0.41
GABRB2 P47870 1/20 0.41
GABRA4 P48169 1/20 0.41
ALOX5 P09917 2/20 0.40
ADRB1 P08588 1/20 0.39
OPRM1 P35372 2/20 0.39
SLC6A9 P48067 1/20 0.39
HSD11B1 P28845 3/20 0.38
HDAC4 P56524 1/20 0.37
L3MBTL1 Q9Y468 2/20 0.37
HSD11B2 P80365 1/20 0.36
HSD17B10 Q99714 2/20 0.35
MEN1 O00255 1/20 0.35
POLB P06746 1/20 0.35
KMT2A Q03164 1/20 0.35

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
SCHEMBL3910153 0.84 OPRM1 (0.40) ALOX5OPRM1SLC6A9HSD11B1HSD11B2
SCHEMBL3902260 0.83 GABRD (0.40) GABRDGABRA1GABRB1GABRA5GABRA3
SCHEMBL27698338 0.81 PRMT6 (0.37) ALOX5HSD17B10MEN1KMT2A
SCHEMBL3900596 0.80 GABRD (0.39) GABRDGABRA1GABRB1GABRA5GABRA3
SCHEMBL3896141 0.78 SIGMAR1 (0.50) OPRM1POLBMAPT
SCHEMBL3909117 0.77 SLC6A4 (0.35) HSD17B10KMT2AHCAR2
SCHEMBL11752803 0.75 HSD11B1 (0.37) GABRDGABRA1GABRB1GABRA5GABRA3
SCHEMBL27679281 0.75 KMT2A (0.34) L3MBTL1HSD17B10MEN1KMT2AMAPT
SCHEMBL4503607 0.72 GRIN1 (0.46) OPRM1SLC6A9HSD11B1L3MBTL1HSD17B10
SCHEMBL2994152 0.69 SIGMAR1 (0.56) OPRM1SLC6A9HSD11B1HSD17B10MEN1

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-1773823-B1 4-ARYLMORPHOLIN-3-ONE DERIVATIVES, PREPARATION AND THERAPEUTIC USE THEREOF SANOFI SA (FR) 2013-08-21 EP disclosed
US-7521449-B2 4-arylmorpholin-3-one derivatives, their preparation and therapeutic use thereof SANOFI-AVENTIS (FR) 2009-04-21 US disclosed
US-20070142349-A1 4-ARYLMORPHOLIN-3-ONE DERIVATIVES, THEIR PREPARATION AND THERAPEUTIC USE THEREOF SANOFI-AVENTIS (FR) 2007-06-21 US disclosed
EP-1773823-A1 4-ARYLMORPHOLIN-3-ONE DERIVATIVES, PREPARATION AND THERAPEUTIC USE THEREOF Sanofi-Aventis (FR) 2007-04-18 EP disclosed
WO-2006021654-A1 4-ARYLMORPHOLIN-3-ONE DERIVATIVES, PREPARATION AND THERAPEUTIC USE THEREOF SANOFI-AVENTIS (FR) 2006-03-02 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20070142349-A1 4-ARYLMORPHOLIN-3-ONE DERIVATIVES, THEIR PREPARATION AND THERAPEUTIC USE THEREOF ADRB3, ADRA2C, OPRK1 GABRD 2217/4885GABRA1 883/4885GABRB1 784/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.