Sulfamide

SCHEMBL4438457

CN1CC[N+](C)(C[C@@H]2OC(=O)N(c3ccc(C(F)(F)F)cc3)[C@H]2c2cccc(F)c2)CC1.NS(N)(=O)=O

nearest known ligand 0.36

Predicted protein targets (top 13)

	gene	UniProt	supporting neighbours	confidence
▸	CA1	P00915	1/20	0.35

▸	CA2	P00918	1/20	0.35

▸	CA9	Q16790	1/20	0.35

▸	TRPV4	Q9HBA0	2/20	0.33

▸	HDAC6	Q9UBN7	1/20	0.33

▸	HTR2A	P28223	1/20	0.32

▸	HTR2C	P28335	1/20	0.32

▸	NR1H2	P55055	3/20	0.32

▸	NR1H3	Q13133	3/20	0.32

▸	POLB	P06746	1/20	0.32

▸	KMT2A	Q03164	1/20	0.32

▸	GFER	P55789	1/20	0.31

▸	PTGS2	P35354	1/20	0.31

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.

Compound	similarity	top predicted	shared targets
SCHEMBL3592352	0.75	ALDH1A1 (0.36)	HTR2CKMT2AGFER
SCHEMBL13168227	0.74	LMNA (0.34)	CA1CA2CA9KMT2A
SCHEMBL4445468	0.73	KCNN4 (0.34)	CA1CA2CA9HTR2ANR1H2
SCHEMBL3593660	0.70	PAX8 (0.35)	POLBKMT2AGFER
SCHEMBL3591176	0.70	KCNN4 (0.36)	—
SCHEMBL4445907	0.70	PAX8 (0.35)	POLBKMT2AGFER
SCHEMBL3599584	0.70	MAPK14 (0.37)	KMT2AGFER
SCHEMBL3589557	0.69	GRM5 (0.40)	POLBKMT2AGFER
SCHEMBL4441032	0.68	DRD2 (0.41)	KMT2A
SCHEMBL15181621	0.66	RXFP1 (0.39)	POLBKMT2AGFER

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

Patent	Title	Assignee	Published	Priority	Filing	Country	Status
EP-2121598-A2	COMPOUNDS AND COMPOSITIONS AS INHIBITORS OF CANNABINOID RECEPTOR 1 ACTIVITY	IRM LLC (BM)	2009-11-25	—	—	EP	disclosed
WO-2008076754-A2	COMPOUNDS AND COMPOSITIONS AS INHIBITORS OF CANNABINOID RECEPTOR 1 ACTIVITY	IRM LLC (BM)	2008-06-26	—	—	WO	disclosed