SCHEMBL7332174

SCHEMBL7332174

CN1CCN(S(=O)(=O)NC(Cc2ccccc2)C(=O)O)CC1

nearest known ligand 0.52

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 7/20 0.51
MMP9 P14780 5/20 0.51
ADAMTS4 O75173 1/20 0.51
ALDH1A1 P00352 4/20 0.49
MAPT P10636 1/20 0.49
POLB P06746 1/20 0.49
HSD17B10 Q99714 2/20 0.49
LMNA P02545 1/20 0.48
TP53 P04637 1/20 0.48
KMT2A Q03164 2/20 0.48
CHRM1 P11229 2/20 0.48
MEN1 O00255 1/20 0.47
ADAMTS5 Q9UNA0 1/20 0.46
MMP1 P03956 1/20 0.46
MMP3 P08254 1/20 0.46
MMP7 P09237 1/20 0.46
MMP13 P45452 1/20 0.46

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
SCHEMBL7332179 1.00 MMP2 (0.51) MMP2MMP9ADAMTS4ALDH1A1MAPT
SCHEMBL7338097 0.87 ITGB3 (0.48) MMP2MMP9POLBHSD17B10CHRM1
SCHEMBL7338091 0.87 ITGB3 (0.48) MMP2MMP9POLBHSD17B10CHRM1
SCHEMBL8683934 0.86 ALDH1A1 (0.58) MMP2MMP9ADAMTS4ALDH1A1MAPT
SCHEMBL7385524 0.84 MEN1 (0.61) MMP2MMP9ADAMTS4ALDH1A1MAPT
SCHEMBL7317104 0.84 MEN1 (0.61) MMP2MMP9ADAMTS4ALDH1A1MAPT
SCHEMBL9437655 0.82 HSD17B10 (0.40) ALDH1A1HSD17B10KMT2ACHRM1MEN1
SCHEMBL9437573 0.82 ALDH1A1 (0.39) ALDH1A1HSD17B10LMNATP53KMT2A
SCHEMBL7350808 0.81 YAP1 (0.54) ALDH1A1MAPT
SCHEMBL9437646 0.81 HSD17B10 (0.40) MMP2MMP9ADAMTS4HSD17B10CHRM1

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