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SCHEMBL14798482

SCHEMBL14798482

CN(CC(=O)O)Cc1ccc(N(CC(=O)OC(C)(C)C)[SH](=O)=O)cc1

nearest known ligand 0.37

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ LTA4H P09960 1/20 0.37
▸ NR1D1 P20393 4/20 0.36
▸ S1PR1 P21453 1/20 0.35
▸ NR1H3 Q13133 1/20 0.35
▸ CTSL P07711 2/20 0.34
▸ CTSB P07858 2/20 0.34
▸ CTSS P25774 2/20 0.34
▸ TSHR P16473 1/20 0.34
▸ AKT1 P31749 2/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.33
▸ GAA P10253 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ CD274 Q9NZQ7 1/20 0.33

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
SCHEMBL14798981 0.83 S1PR1 (0.36) NR1D1S1PR1NR1H3TSHRMEN1
SCHEMBL14798320 0.82 RXRA (0.41) NR1H3
SCHEMBL14839652 0.79 PAX8 (0.44) LTA4HNR1H3CTSLCTSBCTSS
SCHEMBL14798408 0.76 ADRB2 (0.39) NR1H3ALDH1A1
SCHEMBL4743834 0.76 LTA4H (0.46) LTA4HNR1D1S1PR1ALDH1A1
SCHEMBL14805294 0.75 SMN1; SMN2 (0.38) LTA4HMEN1ALDH1A1GAAKMT2A
SCHEMBL28163472 0.73 LTA4H (0.41) LTA4HMEN1ALDH1A1KMT2ACD274
SCHEMBL14798480 0.72 ALDH1A1 (0.40) LTA4HS1PR1MEN1ALDH1A1KMT2A
SCHEMBL20339008 0.72 CTSL (0.48) CTSLCTSBCTSSTSHRAKT1
Hydrochloric Acid SCHEMBL27968630 0.72 LTA4H (0.40) LTA4HTSHRMEN1ALDH1A1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2760838-B1 DERIVATIVES OF 1-PHENYL-2-PYRIDINYL ALKYL ALCOHOLS AS PHOSPHODIESTERASE INHIBITORS CHIESI FARM SPA (IT) 2017-05-10 — — EP disclosed
US-9265768-B2 Derivatives of 1-phenyl-2-pyridinyl alkyl alcohols as phosphodiesterase inhibitors CHIESI FARMACEUTICI S.P.A. (IT) 2016-02-23 — — US disclosed
EP-2760838-A1 DERIVATIVES OF 1-PHENYL-2-PYRIDINYL ALKYL ALCOHOLS AS PHOSPHODIESTERASE INHIBITORS Chiesi Farmaceutici S.p.A. (IT) 2014-08-06 — — EP disclosed
US-20140142074-A1 DERIVATIVES OF 1-PHENYL-2-PYRIDINYL ALKYL ALCOHOLS AS PHOSPHODIESTERASE INHIBITORS CHIESI FARMACEUTICI S.P.A. (IT) 2014-05-22 — — US disclosed
WO-2013045280-A1 DERIVATIVES OF 1-PHENYL-2-PYRIDINYL ALKYL ALCOHOLS AS PHOSPHODIESTERASE INHIBITORS CHIESI FARMACEUTICI S.P.A. (IT) 2013-04-04 — — WO disclosed
US-20130079313-A1 DERIVATIVES OF 1-PHENYL-2-PYRIDINYL ALKYL ALCOHOLS AS PHOSPHODIESTERASE INHIBITORS CHIESI FARMACEUTICI S.P.A. (IT) 2013-03-28 — — 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 (2 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-20130079313-A1 DERIVATIVES OF 1-PHENYL-2-PYRIDINYL ALKYL ALCOHOLS AS PHOSPHODIESTERASE INHIBITORS PDE4A, PDE4B, PDE3A LTA4H 160/4885NR1D1 4124/4885S1PR1 391/4885
US-20140142074-A1 DERIVATIVES OF 1-PHENYL-2-PYRIDINYL ALKYL ALCOHOLS AS PHOSPHODIESTERASE INHIBITORS PDE4A, PDE4B, PDE3A LTA4H 160/4885NR1D1 4124/4885S1PR1 391/4885

“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.