SCHEMBL19200319

SCHEMBL19200319

CCCC(C)(C)CC(=O)N1CCOCC1

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.49
POLB P06746 3/20 0.49
LMNA P02545 2/20 0.49
ALDH1A1 P00352 2/20 0.47
L3MBTL1 Q9Y468 2/20 0.46
RAB9A P51151 1/20 0.45
HPGD P15428 1/20 0.44
RECQL P46063 1/20 0.44
HTT P42858 2/20 0.43
SMN1; SMN2 Q16637 3/20 0.42
USP2 O75604 1/20 0.42
ALOX15 P16050 1/20 0.42
HSD17B10 Q99714 1/20 0.42
GLA P06280 1/20 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
SCHEMBL18922367 0.90 POLB (0.49) TSHRPOLBLMNAALDH1A1L3MBTL1
SCHEMBL8379974 0.86 L3MBTL1 (0.48) TSHRPOLBLMNAALDH1A1L3MBTL1
SCHEMBL21567963 0.85 KDM4E (0.46) TSHRPOLBLMNAALDH1A1L3MBTL1
SCHEMBL19728850 0.84 L3MBTL1 (0.48) POLBALDH1A1L3MBTL1HPGDSMN1; SMN2
SCHEMBL19200801 0.83 L3MBTL1 (0.43) TSHRPOLBLMNAALDH1A1L3MBTL1
SCHEMBL4193078 0.83 L3MBTL1 (0.46) TSHRPOLBLMNAALDH1A1L3MBTL1
SCHEMBL24339478 0.82 L3MBTL1 (0.50) POLBALDH1A1L3MBTL1HPGDHTT
SCHEMBL20112946 0.82 RAB9A (0.56) TSHRPOLBLMNAALDH1A1L3MBTL1
SCHEMBL23119558 0.81 POLB (0.47) TSHRPOLBLMNAALDH1A1L3MBTL1
SCHEMBL5527414 0.81 L3MBTL1 (0.47) TSHRPOLBLMNAALDH1A1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12016835-B2 Neprilysin inhibitors THERAVANCE BIOPHARMA R&D IP, LLC (US) 2024-06-25 US disclosed
US-20230285340-A1 NEPRILYSIN INHIBITORS THERAVANCE BIOPHARMA R&D IP LLC (US) 2023-09-14 US disclosed
US-11571426-B2 Compositions for preventing or treating lupus CHONG KUN DANG PHARMACEUTICAL CORP. 2023-02-07 US disclosed
US-11547687-B2 Neprilysin inhibitors THERAVANCE BIOPHARMA R&D IP, LLC (US) 2023-01-10 US disclosed
US-20210059966-A1 NEPRILYSIN INHIBITORS THERAVANCE BIOPHARMA R&D IP, LLC (US) 2021-03-04 US disclosed
US-20200368245-A1 COMPOSITIONS FOR PREVENTING OR TREATING LUPUS CHONG KUN DANG PHARMACEUTICAL CORP. (KR) 2020-11-26 US disclosed
US-10172858-B2 Combination pharmaceutical compositions and uses thereof INTELLIKINE LLC (US) 2019-01-08 US disclosed
US-20180118705-A1 PROCESS FOR PREPARING 4-AMINO-5-BIPHENYL-4-YL-2-HYDROXYMETHYL-2-METHYL-PENTANOIC ACID COMPOUND THERAVANCE BIOPHARMA R&D IP, LLC (US) 2018-05-03 US disclosed
US-20170216252-A1 ANTI-BACTERIAL PYRUVATE KINASE MODULATOR COMPOUNDS, COMPOSITIONS, USES AND METHODS SIMON FRASER UNIVERSITY (CA) 2017-08-03 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 (9 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-20230285340-A1 NEPRILYSIN INHIBITORS MME, REN, ACE TSHR 1031/4885POLB 1844/4885LMNA 553/4885
US-11547687-B2 Neprilysin inhibitors MME, REN, ACE TSHR 1031/4885POLB 1844/4885LMNA 553/4885
US-11571426-B2 Compositions for preventing or treating lupus SSB, TLR9, TLR5 TSHR 3279/4885POLB 3661/4885LMNA 115/4885
US-20180118705-A1 PROCESS FOR PREPARING 4-AMINO-5-BIPHENYL-4-YL-2-HYDROXYMETHYL-2-METHYL-PENTANOIC ACID COMPOUND CYP4B1, P2RX5, P2RX6 TSHR 1935/4885POLB 1371/4885LMNA 1758/4885
US-20170216252-A1 ANTI-BACTERIAL PYRUVATE KINASE MODULATOR COMPOUNDS, COMPOSITIONS, USES AND METHODS PDK1, PDK3, PDK2 TSHR 3492/4885POLB 844/4885LMNA 2835/4885
US-20200368245-A1 COMPOSITIONS FOR PREVENTING OR TREATING LUPUS SSB, TLR9, TLR5 TSHR 3279/4885POLB 3661/4885LMNA 115/4885
US-20210059966-A1 NEPRILYSIN INHIBITORS MME, REN, ACE TSHR 1031/4885POLB 1844/4885LMNA 553/4885
US-10172858-B2 Combination pharmaceutical compositions and uses thereof CDC25C, CCNC, CDC25B TSHR 4341/4885POLB 313/4885LMNA 1699/4885
US-12016835-B2 Neprilysin inhibitors MME, REN, ACE TSHR 1031/4885POLB 1844/4885LMNA 553/4885

“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.