SCHEMBL17646277

SCHEMBL17646277

O=C(NCCCC[C@H](NC(=O)C1CCCC1)C(=O)c1nccs1)OCc1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
F2 P00734 3/20 0.49
FOLH1 Q04609 2/20 0.48
HDAC6 Q9UBN7 1/20 0.47
ITGB3 P05106 1/20 0.47
ITGA2B P08514 1/20 0.47
PRSS1 P07477 1/20 0.45
ANPEP P15144 1/20 0.45
CTSK P43235 1/20 0.45
MMP2 P08253 1/20 0.44
MMP9 P14780 1/20 0.44
KLK7 P49862 1/20 0.43
KLK5 Q9Y337 1/20 0.43
DPP4 P27487 1/20 0.43
DPP8 Q6V1X1 1/20 0.43
DPP9 Q86TI2 1/20 0.43
DPP7 Q9UHL4 1/20 0.43

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
SCHEMBL17646349 0.86 TGM2 (0.51) FOLH1ITGB3ITGA2BANPEPMMP2
SCHEMBL19665781 0.86 TGM2 (0.51) FOLH1ITGB3ITGA2BANPEPMMP2
SCHEMBL17666010 0.85 FOLH1 (0.52) FOLH1HDAC6ANPEPMMP2MMP9
SCHEMBL10770977 0.83 FOLH1 (0.64) FOLH1ITGB3ITGA2BMMP2MMP9
SCHEMBL17646234 0.83 HDAC3 (0.51) FOLH1HDAC6ITGB3ITGA2B
SCHEMBL28341581 0.83 HDAC3 (0.51) FOLH1HDAC6ITGB3ITGA2B
SCHEMBL17646323 0.82 MAPT (0.60) FOLH1HDAC6ITGB3ITGA2BKLK7
SCHEMBL28341577 0.82 MAPT (0.60) FOLH1HDAC6ITGB3ITGA2BKLK7
SCHEMBL17646238 0.82 HDAC3 (0.50) HDAC6ITGB3ITGA2B
SCHEMBL22150083 0.82 HDAC3 (0.50) HDAC6ITGB3ITGA2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11332464-B2 Inhibitors of lysine gingipain Cortexyme, Inc. (US) 2022-05-17 US disclosed
US-20210017167-A1 INHIBITORS OF LYSINE GINGIPAIN Cortexyme, Inc. (US) 2021-01-21 US disclosed
EP-3204352-B1 INHIBITORS OF LYSINE GINGIPAIN CORTEXYME INC (US) 2020-07-01 EP disclosed
US-10676470-B2 Inhibitors of lysine gingipain Cortexyme, Inc. (US) 2020-06-09 US disclosed
US-20190322659-A1 INHIBITORS OF LYSINE GINGIPAIN Cortexyme, Inc. (US) 2019-10-24 US disclosed
US-10301301-B2 Inhibitors of lysine gingipain Cortexyme, Inc. (US) 2019-05-28 US disclosed
US-20180346460-A1 INHIBITORS OF LYSINE GINGIPAIN Cortexyme, Inc. (US) 2018-12-06 US disclosed
US-9988375-B2 Inhibitors of lysine gingipain Cortexyme, Inc. (US) 2018-06-05 US disclosed
US-9988375-B2 Inhibitors of lysine gingipain Cortexyme, Inc. (US) 2018-06-05 US disclosed
US-20170349537-A1 INHIBITORS OF LYSINE GINGIPAIN Cortexyme, Inc. (US) 2017-12-07 US disclosed
US-20170349537-A1 INHIBITORS OF LYSINE GINGIPAIN Cortexyme, Inc. (US) 2017-12-07 US disclosed
US-20170349537-A1 INHIBITORS OF LYSINE GINGIPAIN Cortexyme, Inc. (US) 2017-12-07 US disclosed
US-9758473-B2 Inhibitors of lysine gingipain Cortexyme, Inc. (US) 2017-09-12 US disclosed
US-9758473-B2 Inhibitors of lysine gingipain Cortexyme, Inc. (US) 2017-09-12 US disclosed
US-9758473-B2 Inhibitors of lysine gingipain Cortexyme, Inc. (US) 2017-09-12 US disclosed
WO-2016057413-A2 INHIBITORS OF LYSINE GINGIPAIN Cortexyme, Inc. (US) 2016-04-14 WO disclosed
US-20160096830-A1 INHIBITORS OF LYSINE GINGIPAIN Cortexyme, Inc. (US) 2016-04-07 US disclosed
US-20160096830-A1 INHIBITORS OF LYSINE GINGIPAIN Cortexyme, Inc. (US) 2016-04-07 US disclosed
US-20160096830-A1 INHIBITORS OF LYSINE GINGIPAIN Cortexyme, Inc. (US) 2016-04-07 US 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 (8 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-20180346460-A1 INHIBITORS OF LYSINE GINGIPAIN ENPEP, PHYKPL, PREP F2 1206/4885FOLH1 216/4885HDAC6 1180/4885
US-20190322659-A1 INHIBITORS OF LYSINE GINGIPAIN ENPEP, PHYKPL, PREP F2 1206/4885FOLH1 216/4885HDAC6 1180/4885
US-20210017167-A1 INHIBITORS OF LYSINE GINGIPAIN ENPEP, PHYKPL, PREP F2 1206/4885FOLH1 216/4885HDAC6 1180/4885
US-10676470-B2 Inhibitors of lysine gingipain ENPEP, PHYKPL, PREP F2 1206/4885FOLH1 216/4885HDAC6 1180/4885
US-20170349537-A1 INHIBITORS OF LYSINE GINGIPAIN ENPEP, PHYKPL, PREP F2 1206/4885FOLH1 216/4885HDAC6 1180/4885
US-20160096830-A1 INHIBITORS OF LYSINE GINGIPAIN ENPEP, PHYKPL, PREP F2 1206/4885FOLH1 216/4885HDAC6 1180/4885
US-11332464-B2 Inhibitors of lysine gingipain ENPEP, PHYKPL, PREP F2 1206/4885FOLH1 216/4885HDAC6 1180/4885
US-10301301-B2 Inhibitors of lysine gingipain ENPEP, PHYKPL, PREP F2 1206/4885FOLH1 216/4885HDAC6 1180/4885

“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.