SCHEMBL1619583

SCHEMBL1619583

CCN(CC)C(=O)[C@@H](N)C(C)C

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 5/20 0.47
SLC7A5 Q01650 1/20 0.44
ALDH1A1 P00352 2/20 0.36
LMNA P02545 1/20 0.36
MMP1 P03956 1/20 0.34
MMP2 P08253 1/20 0.34
MMP3 P08254 1/20 0.34
MMP8 P22894 1/20 0.34
HTT P42858 1/20 0.34
DPP8 Q6V1X1 2/20 0.33
DPP9 Q86TI2 2/20 0.33
DPP7 Q9UHL4 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
HTR1A P08908 1/20 0.33
FAP Q12884 1/20 0.33
LAP3 P28838 1/20 0.32
SLC1A3 P43003 1/20 0.31
SLC1A2 P43004 1/20 0.31
SLC1A1 P43005 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.

Compoundsimilaritytop predictedshared targets
SCHEMBL1619585 1.00 DPP4 (0.47) DPP4SLC7A5ALDH1A1LMNAMMP1
SCHEMBL19883548 0.87 CA12 (0.42) DPP4SLC7A5LMNAMMP1MMP2
SCHEMBL8613006 0.82 DPP4 (0.43) DPP4DPP8DPP9DPP7
SCHEMBL19981940 0.82 DPP4 (0.44) DPP4SLC7A5ALDH1A1LMNADPP8
SCHEMBL8613010 0.82 DPP4 (0.43) DPP4DPP8DPP9DPP7
Hydrochloric Acid SCHEMBL8615960 0.80 DPP4 (0.42) DPP4DPP8DPP9DPP7
Hydrochloric Acid SCHEMBL8615969 0.80 DPP4 (0.42) DPP4DPP8DPP9DPP7
SCHEMBL3948078 0.80 DPP4 (0.42) DPP4ALDH1A1LMNAMMP1MMP2
SCHEMBL5438409 0.80 DPP4 (0.42) DPP4ALDH1A1LMNAMMP1MMP2
SCHEMBL23368288 0.79 DPP4 (0.42) DPP4SLC7A5DPP8DPP9DPP7

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 22 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11292783-B2 Substituted 1,2,3,4-tetrahydroisoquinolines as kappa opioid antagonists RESEARCH TRIANGLE INSTITUTE (NC) 2022-04-05 US disclosed
US-20220079924-A1 GLUCOCORTICOID RECEPTOR MODULATORS ORIC PHARMACEUTICALS, INC. 2022-03-17 US disclosed
EP-3512832-B1 TETRAHYDROISOQUINOLINE KAPPA OPIOID ANTAGONISTS RES TRIANGLE INST (US) 2021-05-19 EP disclosed
US-20210122730-A1 GLUCOCORTICOID RECEPTOR MODULATORS ORIC PHARMACEUTICALS, INC. 2021-04-29 US disclosed
US-20210122730-A1 GLUCOCORTICOID RECEPTOR MODULATORS ORIC PHARMACEUTICALS, INC. 2021-04-29 US disclosed
EP-3609872-A1 GLUCOCORTICOID RECEPTOR MODULATORS Oric Pharmaceuticals, Inc. (US) 2020-02-19 EP disclosed
US-20190263781-A1 Tetrahydroisoquinoline Kappa Opioid Antagonists RESEARCH TRIANGLE INSTITUTE (US) 2019-08-29 US disclosed
WO-2018191283-A1 GLUCOCORTICOID RECEPTOR MODULATORS ORIC PHARMACEUTICALS, INC. (US) 2018-10-18 WO disclosed
WO-2018053222-A1 TETRAHYDROISOQUINOLINE KAPPA OPIOID ANTAGONISTS RESEARCH TRAINGLE INSTITUTE (US) 2018-03-22 WO disclosed
US-8829024-B2 Combination steroid and glucocorticoid receptor antagonist therapy CORCEPT THERAPEUTICS, INC. (US) 2014-09-09 US disclosed
US-8557839-B2 Fused ring azadecalin glucocorticoid receptor modulators CORCEPT THERAPEUTICS, INC. (US) 2013-10-15 US disclosed
US-20130012486-A1 COMBINATION STEROID AND GLUCOCORTICOID RECEPTOR ANTAGONIST THERAPY Corcept Therapeutics, Inc. (019904) (US) 2013-01-10 US disclosed
US-20120225856-A1 FUSED RING AZADECALIN GLUCOCORTICOID RECEPTOR MODULATORS CORCEPT THERAPEUTICS, INC. (US) 2012-09-06 US disclosed
WO-2012094618-A1 COMBINATION STEROID AND GLUCOCORTICOID RECEPTOR ANTAGONIST THERAPY CORCEPT THERAPEUTICS, INC. (US) 2012-07-12 WO disclosed
US-20110166110-A1 Fused Ring Azadecalin Glucocorticoid Receptor Modulators CORCEPT THERAPEUTICS, INC. (US) 2011-07-07 US disclosed
US-7928237-B2 Fused ring azadecalin glucocorticoid receptor modulators CORCEPT THERAPEUTICS, INC. (US) 2011-04-19 US disclosed
EP-1735308-B1 FUSED RING AZADECALIN GLUCOCORTICOID RECEPTOR MODULATORS CORCEPT THERAPEUTICS INC (US) 2008-09-10 EP disclosed
US-20070281928-A1 Fused Ring Azadecalin Glucocorticoid Receptor Modulators CORCEPT THERAPEUTICS INCORPORATED 2007-12-06 US disclosed
EP-1735308-A1 FUSED RING AZADECALIN GLUCOCORTICOID RECEPTOR MODULATORS Corcept Therapeutics, Inc. (US) 2006-12-27 EP disclosed
WO-2005087769-A1 FUSED RING AZADECALIN GLUCOCORTICOID RECEPTOR MODULATORS CORCEPT THERAPEUTICS, INC. (US) 2005-09-22 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 (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-20110166110-A1 Fused Ring Azadecalin Glucocorticoid Receptor Modulators NR3C1, NR3C2, NR5A2 DPP4 2714/4885SLC7A5 4425/4885ALDH1A1 4094/4885
US-11292783-B2 Substituted 1,2,3,4-tetrahydroisoquinolines as kappa opioid antagonists OPRK1, OPRD1, OPRM1 DPP4 3504/4885SLC7A5 1653/4885ALDH1A1 637/4885
US-20120225856-A1 FUSED RING AZADECALIN GLUCOCORTICOID RECEPTOR MODULATORS NR3C1, NR3C2, NR5A2 DPP4 2714/4885SLC7A5 4425/4885ALDH1A1 4094/4885
US-20210122730-A1 GLUCOCORTICOID RECEPTOR MODULATORS NR3C1, NR3C2, NR5A1 DPP4 2883/4885SLC7A5 3801/4885ALDH1A1 3599/4885
US-20190263781-A1 Tetrahydroisoquinoline Kappa Opioid Antagonists OPRK1, OPRD1, OPRM1 DPP4 3757/4885SLC7A5 1983/4885ALDH1A1 977/4885
US-20130012486-A1 COMBINATION STEROID AND GLUCOCORTICOID RECEPTOR ANTAGONIST THERAPY NR3C1, NR3C2, NR5A1 DPP4 2088/4885SLC7A5 4725/4885ALDH1A1 3786/4885
US-20220079924-A1 GLUCOCORTICOID RECEPTOR MODULATORS NR3C1, NR3C2, NR5A1 DPP4 2883/4885SLC7A5 3801/4885ALDH1A1 3599/4885
US-20070281928-A1 Fused Ring Azadecalin Glucocorticoid Receptor Modulators NR3C1, NR3C2, NR5A2 DPP4 2714/4885SLC7A5 4425/4885ALDH1A1 4094/4885

“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.