SCHEMBL2255128

SCHEMBL2255128

c1ccc(CNN2CCCC2)cc1

nearest known ligand 0.52

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
DPP7 Q9UHL4 1/20 0.52
SLC6A3 Q01959 1/20 0.45
SIGMAR1 Q99720 3/20 0.44
ADORA2A P29274 3/20 0.43
ADORA1 P30542 3/20 0.43
IDO1 P14902 2/20 0.43
KMT2A Q03164 2/20 0.43
THRB P10828 1/20 0.43
MEN1 O00255 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
KDM4E B2RXH2 2/20 0.42
ALDH1A1 P00352 1/20 0.42
POLB P06746 1/20 0.42
ACHE P22303 1/20 0.41
CYP3A4 P08684 2/20 0.41
MAPT P10636 2/20 0.41

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
SCHEMBL518257 0.98 DPP7 (0.50) DPP7SLC6A3SIGMAR1ADORA2AADORA1
SCHEMBL8647480 0.96 DPP7 (0.47) DPP7SLC6A3SIGMAR1ADORA2AADORA1
SCHEMBL10726346 0.91 IDO1 (0.46) DPP7SIGMAR1IDO1KMT2ATHRB
Trifluoroacetic Acid SCHEMBL8843994 0.83 L3MBTL1 (0.49) DPP7ADORA2AADORA1KMT2ATDP1
SCHEMBL7695234 0.82 SIGMAR1 (0.53) SLC6A3SIGMAR1KMT2AMEN1ALDH1A1
SCHEMBL112951 0.82 HTT (0.51) SIGMAR1ADORA2AADORA1KDM4EALDH1A1
SCHEMBL7375501 0.79 SIGMAR1 (0.56) DPP7SLC6A3SIGMAR1IDO1TDP1
SCHEMBL7327938 0.78 SIGMAR1 (0.54) DPP7SLC6A3SIGMAR1IDO1TDP1
SCHEMBL5269158 0.77 KMT2A (0.57) SIGMAR1KMT2AMEN1ALDH1A1
SCHEMBL4675392 0.77 CHRNB2 (0.57) KDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2008077651-A1 PYRIDO(3,2-D)PYRIMIDINES USEFUL FOR TREATING VIRAL INFECTIONS GILEAD SCIENCES, INC. (US) 2008-07-03 WO claimed
EP-4308125-B1 PLASMA KALLIKREIN INHIBITORS MERCK SHARP & DOHME LLC (US) 2026-04-22 EP disclosed
US-20240190892-A1 PLASMA KALLIKREIN INHIBITORS MERCK SHARP & DOHME LLC (US) 2024-06-13 US disclosed
EP-4308125-A1 PLASMA KALLIKREIN INHIBITORS Merck Sharp & Dohme LLC (US) 2024-01-24 EP disclosed
WO-2022197761-A1 PLASMA KALLIKREIN INHIBITORS MERCK SHARP & DOHME LLC (US) 2022-09-22 WO disclosed
CN-103140580-B Aminotransferase, gene encoding the same, and method for using the same KANEKA CORP. (JP) 2016-06-01 CN disclosed
EP-2537845-B1 6H-DIBENZO[B,E]OXEPINE DERIVED NONSTEROIDAL MINERALOCORTICOID RECEPTOR ANTAGONISTS LILLY CO ELI (US) 2014-03-19 EP disclosed
EP-2537845-A1 6H-dibenzo[B,E]oxepine derived nonsteroidal mineralocorticoid receptor antagonists Eli Lilly and Company (US) 2012-12-26 EP disclosed
EP-2235007-B1 6H-DIBENZ0 [B, E] OXEPINE DERIVED NONSTEROIDAL MINERALOCORTICOID RECEPTOR ANTAGONISTS LILLY CO ELI (US) 2012-10-31 EP disclosed
US-7994164-B2 Mineralocorticoid receptor antagonists and methods of use ELI LILLY AND COMPANY (US) 2011-08-09 US disclosed
EP-2235007-A1 6H-DIBENZ0 [B, E] OXEPINE DERIVED NONSTEROIDAL MINERALOCORTICOID RECEPTOR ANTAGONISTS ELI LILLY AND COMPANY (US) 2010-10-06 EP disclosed
WO-2009085584-A1 6H-DIBENZ0 [B, E] OXEPINE DERIVED NONSTEROIDAL MINERALOCORTICOID RECEPTOR ANTAGONISTS ELI LILLY AND COMPANY (US) 2009-07-09 WO disclosed
US-20090163472-A1 MINERALOCORTICOID RECEPTOR ANTAGONISTS AND METHODS OF USE ELI LILLY AND COMPANY 2009-06-25 US disclosed
WO-2008077651-A1 PYRIDO(3,2-D)PYRIMIDINES USEFUL FOR TREATING VIRAL INFECTIONS GILEAD SCIENCES, INC. (US) 2008-07-03 WO disclosed
US-20070073064-A1 Method for producing aminopyrrolidine derivatives and intermediate compounds TEIJIN PHARMA LIMITED (JP) 2007-03-29 US disclosed
US-20060160794-A1 Tachykinin receptor antagonists ELI LILLY AND COMPANY 2006-07-20 US disclosed
EP-1676837-A1 PROCESS FOR PRODUCING AMINOPYRROLIDINE DERIVATIVE AND INTERMEDIATE COMPOUND Teijin Pharma Limited (JP) 2006-07-05 EP disclosed
US-6646093-B2 Extruding auxiliary for cement materials, a mortar thickening agent, an underwater concrete thickening agent, a ceramics forming binder and a moisturizer for hair cosmetics; water and shape retention. MITSUI CHEMICALS, INC. (JP) 2003-11-11 US disclosed
US-20020045724-A1 Water-souluble polyurthane having comb-shaped hydrophobic group and application thereof MITSUI TAKEDA CHEMICALS, INC. (JP) 2002-04-18 US disclosed
US-6369077-B1 OSTEOPOROSIS, PERIODONTITIS, AND ARTHRITIS SMITHKLINE BEECHAM CORPORATION 2002-04-09 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 (5 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-20090163472-A1 MINERALOCORTICOID RECEPTOR ANTAGONISTS AND METHODS OF USE NR3C2, MC2R, REN DPP7 1996/4885SLC6A3 412/4885SIGMAR1 483/4885
US-20060160794-A1 Tachykinin receptor antagonists TACR1, TACR2, PROKR1 DPP7 1456/4885SLC6A3 313/4885SIGMAR1 576/4885
US-20240190892-A1 PLASMA KALLIKREIN INHIBITORS KLKB1, SERPINE1, SERPINB1 DPP7 639/4885SLC6A3 4320/4885SIGMAR1 4827/4885
US-20020045724-A1 Water-souluble polyurthane having comb-shaped hydrophobic group and application thereof BMI1, ASH2L, HAT1 DPP7 4707/4885SLC6A3 3127/4885SIGMAR1 2186/4885
US-20070073064-A1 Method for producing aminopyrrolidine derivatives and intermediate compounds ACKR3, CCR2, CCR5 DPP7 1507/4885SLC6A3 1815/4885SIGMAR1 228/4885

“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.