SCHEMBL7330956

SCHEMBL7330956

CC(C(N)=O)N(C(=O)C(Cc1ccccc1)CS(=O)(=O)N1CCN(C)CC1)c1nccs1

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
REN P00797 3/20 0.46
CTSS P25774 1/20 0.39
F10 P00742 5/20 0.37
OPRL1 P41146 1/20 0.37
HSD17B10 Q99714 1/20 0.36
F2 P00734 3/20 0.35
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
PLG P00747 1/20 0.34
PLAT P00750 1/20 0.34
PRSS1 P07477 1/20 0.34
CHRM1 P11229 5/20 0.34
ALDH1A1 P00352 1/20 0.32
LMNA P02545 1/20 0.32
POLB P06746 1/20 0.32
MAPT P10636 1/20 0.32
HTT P42858 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32

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
SCHEMBL7330659 0.97 REN (0.46) RENCTSSF10OPRL1HSD17B10
SCHEMBL7337422 0.92 REN (0.40) RENCTSSF10OPRL1F2
SCHEMBL7338907 0.92 KMT2A (0.41) RENCTSSF10OPRL1F2
SCHEMBL7333699 0.89 REN (0.38) RENCTSSF10OPRL1F2
SCHEMBL7339920 0.87 REN (0.36) RENCTSSF10OPRL1F2
SCHEMBL7336887 0.84 REN (0.38) RENF10HSD17B10F2PLG
SCHEMBL7331301 0.84 REN (0.45) RENCTSSF10OPRL1HSD17B10
SCHEMBL7339498 0.84 REN (0.38) RENCTSSF10OPRL1HSD17B10
SCHEMBL7332856 0.83 REN (0.38) RENCTSSOPRL1HSD17B10MEN1
SCHEMBL7339105 0.82 HSD17B10 (0.37) RENCTSSHSD17B10KMT2ACHRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5332742-A Ocular hypotensive ABBOTT LABORATORIES (US) 1994-07-26 US disclosed
US-5310740-A Congestive heart failure, hypotensive agents, antiglaucoma agents; side effect reduction ABBOTT LABORATORIES (US) 1994-05-10 US disclosed
US-5284849-A Treating hypertension and congestive heart failure ABBOTT LABORATORIES (US) 1994-02-08 US disclosed
EP-0456185-A2 Renin inhibitors ABBOTT LABORATORIES (US) 1991-11-13 EP disclosed