SCHEMBL15038548

SCHEMBL15038548

COC(C)C(C)C(=O)N1C(C)CC[C@H]1C

nearest known ligand 0.36

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PHGDH O43175 1/20 0.36
DPP4 P27487 2/20 0.36
RECQL P46063 1/20 0.32
MEN1 O00255 1/20 0.32
ALDH1A1 P00352 1/20 0.32
KMT2A Q03164 1/20 0.32
TSHR P16473 1/20 0.31
MGLL Q99685 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
SCHEMBL19884189 1.00 PHGDH (0.36) PHGDHDPP4RECQLMEN1ALDH1A1
SCHEMBL15692151 1.00 PHGDH (0.36) PHGDHDPP4RECQLMEN1ALDH1A1
SCHEMBL21145954 0.88 DPP4 (0.32) PHGDHDPP4
SCHEMBL20247486 0.88 DPP4 (0.32) PHGDHDPP4
SCHEMBL15832339 0.85 DPP4 (0.33) PHGDHDPP4
SCHEMBL19527999 0.85 DPP4 (0.33) PHGDHDPP4
SCHEMBL18994025 0.85 DPP4 (0.33) PHGDHDPP4
SCHEMBL19528227 0.79 PHGDH (0.41) PHGDHDPP4RECQLMEN1ALDH1A1
SCHEMBL15038544 0.79 PHGDH (0.41) PHGDHDPP4RECQLMEN1ALDH1A1
SCHEMBL19658092 0.79 PHGDH (0.41) PHGDHDPP4RECQLMEN1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3699176-A2 ANTIVIRAL COMPOUNDS Gilead Pharmasset LLC (US) 2020-08-26 EP disclosed
EP-3431477-A1 CONDENSED IMIDAZOLYLIMIDAZOLES AS ANTIVIRAL COMPOUNDS Gilead Pharmasset LLC (US) 2019-01-23 EP disclosed
EP-2907816-B1 Condensed imidazolylimidazoles as antiviral compounds GILEAD PHARMASSET LLC (US) 2018-06-13 EP disclosed
EP-3284741-A1 ANTIVIRAL COMPOUNDS Gilead Pharmasset LLC (US) 2018-02-21 EP disclosed
US-20170342085-A1 ANTIVIRAL COMPOUNDS GILEAD SCIENCES, INC. 2017-11-30 US disclosed
US-9809600-B2 Antiviral compounds GILEAD PHARMASSET LLC (US) 2017-11-07 US disclosed
EP-3239152-A1 ANTIVIRAL COMPOUNDS Gilead Sciences, Inc. (US) 2017-11-01 EP disclosed
EP-3239153-A1 9-(1H-IMIDAZOL-5-YL)-1,11-DIHYDROISOCHROMENO[4',3':6,7]NAPHTHO[1,2-D]IMIDAZOLE DERIVATIVES AND THEIR USE AS INHIBITORS OF HCV NS5A Gilead Pharmasset LLC (US) 2017-11-01 EP disclosed
US-9682989-B2 Antiviral compounds GILEAD PHARMASSET LLC (US) 2017-06-20 US disclosed
US-20170145027-A1 ANTIVIRAL COMPOUNDS GILEAD SCIENCES, INC. 2017-05-25 US disclosed
US-8940718-B2 Antiviral compounds GILEAD PHARMASSET LLC (US) 2015-01-27 US disclosed
US-8921341-B2 Antiviral compounds GILEAD PHARMASSET LLC (US) 2014-12-30 US disclosed
US-20140316144-A1 ANTIVIRAL COMPOUNDS GILEAD PHARMASSET LLC 2014-10-23 US disclosed
US-20140178336-A1 ANTIVIRAL COMPOUNDS GILEAD SCIENCES, INC. 2014-06-26 US disclosed
US-20140112885-A1 ANTIVIRAL COMPOUNDS GILEAD SCIENCES, INC. (US) 2014-04-24 US disclosed
US-20140018313-A1 ANTIVIRAL COMPOUNDS Gelead Sciences, Inc. 2014-01-16 US disclosed
US-8575135-B2 Antiviral compounds GILEAD SCIENCES, INC. (US) 2013-11-05 US disclosed
US-20130177530-A1 ANTIVIRAL COMPOUNDS GILEAD SCIENCES, INC. (US) 2013-07-11 US disclosed
US-20130164260-A1 ANTIVIRAL COMPOUNDS GILEAD SCIENCES, INC. (US) 2013-06-27 US disclosed
US-20130156732-A1 ANTIVIRAL COMPOUNDS GILEAD SCIENCES, INC. (US) 2013-06-20 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-20140018313-A1 ANTIVIRAL COMPOUNDS MAVS, EIF2AK2, ZC3HAV1 PHGDH 2018/4885DPP4 77/4885RECQL 558/4885
US-20170145027-A1 ANTIVIRAL COMPOUNDS MAVS, EIF2AK2, SARS1 PHGDH 2273/4885DPP4 136/4885RECQL 247/4885
US-20130177530-A1 ANTIVIRAL COMPOUNDS MAVS, EIF2AK2, SARS1 PHGDH 2273/4885DPP4 136/4885RECQL 247/4885
US-20170342085-A1 ANTIVIRAL COMPOUNDS MAVS, EIF2AK2, SARS1 PHGDH 2273/4885DPP4 136/4885RECQL 247/4885
US-20140112885-A1 ANTIVIRAL COMPOUNDS MAVS, EIF2AK2, SARS1 PHGDH 2273/4885DPP4 136/4885RECQL 247/4885
US-20130156732-A1 ANTIVIRAL COMPOUNDS MAVS, EIF2AK2, SARS1 PHGDH 2273/4885DPP4 136/4885RECQL 247/4885
US-20130164260-A1 ANTIVIRAL COMPOUNDS MAVS, EIF2AK2, SARS1 PHGDH 2273/4885DPP4 136/4885RECQL 247/4885
US-20140178336-A1 ANTIVIRAL COMPOUNDS MAVS, EIF2AK2, SARS1 PHGDH 2273/4885DPP4 136/4885RECQL 247/4885
US-20140316144-A1 ANTIVIRAL COMPOUNDS MAVS, EIF2AK2, SARS1 PHGDH 2273/4885DPP4 136/4885RECQL 247/4885

“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.