SCHEMBL1626465

SCHEMBL1626465

CCOC(=O)C#Cc1c(Cl)cccc1C(C)(C)C(=O)OCC

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ABCB11 O95342 1/20 0.37
▸ CYP1A2 P05177 1/20 0.37
▸ CYP3A4 P08684 1/20 0.37
▸ TSHR P16473 1/20 0.37
▸ HTR2A P28223 1/20 0.37
▸ PMP22 Q01453 1/20 0.37
▸ PPARA Q07869 1/20 0.37
▸ ALDH1A1 P00352 3/20 0.36
▸ CNR2 P34972 4/20 0.36
▸ MAPT P10636 2/20 0.36
▸ L3MBTL1 Q9Y468 2/20 0.36
▸ MAOB P27338 1/20 0.35
▸ NLRP3 Q96P20 1/20 0.35
▸ HTT P42858 1/20 0.35
▸ PIN1 Q13526 1/20 0.33
▸ LMNA P02545 2/20 0.33
▸ RORC P51449 1/20 0.33
▸ OPRK1 P41145 1/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ MAPK1 P28482 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
SCHEMBL3839065 0.90 ABCB11 (0.37) ABCB11CYP1A2CYP3A4TSHRHTR2A
SCHEMBL1626647 0.86 KDM4E (0.38) ALDH1A1CNR2PIN1KDM4EMAPK1
SCHEMBL12168758 0.84 ALDH1A1 (0.45) ABCB11CYP1A2CYP3A4TSHRPMP22
SCHEMBL1627032 0.78 TSHR (0.46) ABCB11CYP1A2CYP3A4TSHRHTR2A
SCHEMBL1626474 0.76 ALDH1A1 (0.42) ABCB11CYP1A2CYP3A4TSHRHTR2A
SCHEMBL4637931 0.71 PTGDR2 (0.47) CYP3A4TSHRALDH1A1L3MBTL1NLRP3
SCHEMBL31619477 0.69 ALDH1A1 (0.41) ABCB11CYP1A2CYP3A4TSHRHTR2A
SCHEMBL19216548 0.69 ABCB1 (0.43) TSHRALDH1A1CNR2MAPTKDM4E
SCHEMBL28008282 0.69 NLRP3 (0.39) TSHRALDH1A1L3MBTL1NLRP3PIN1
SCHEMBL10900238 0.68 ABCB11 (0.42) ABCB11CYP1A2CYP3A4TSHRHTR2A

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
US-7928139-B2 Naphthalenone compounds exhibiting prolyl hydroxylase inhibitory activity, compositions, and uses thereof AMGEN INC. (US) 2011-04-19 — — US disclosed
US-20100048572-A1 NAPHTHALENONE COMPOUNDS EXHIBITING PROLYL HYDROXYLASE INHIBITORY ACTIVITY, COMPOSITIONS, AND USES THEREOF AMGEN INC. (US) 2010-02-25 — — US disclosed
US-7635715-B2 Naphthalenone compounds exhibiting prolyl hydroxylase inhibitory activity, compositions, and uses thereof AMGEN INC. (US) 2009-12-22 — — US disclosed
EP-2111399-A2 NAPHTHALENONE COMPOUNDS EXHIBITING PROLYL HYDROXYLASE INHIBITORY ACTIVITY, COMPOSITIONS, AND USES THEREOF Amgen Inc. (US) 2009-10-28 — — EP disclosed
US-20090093483-A1 Naphthalenone compounds exhibiting prolyl hydroxylase inhibitory activity, compositions, and uses thereof AMGEN INC. (US) 2009-04-09 — — US disclosed
WO-2008076427-A2 NAPHTHALENONE COMPOUNDS EXHIBITING PROLYL HYDROXYLASE INHIBITORY ACTIVITY, COMPOSITIONS, AND USES THEREOF AMGEN INC. (US) 2008-06-26 — — 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 (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-20100048572-A1 NAPHTHALENONE COMPOUNDS EXHIBITING PROLYL HYDROXYLASE INHIBITORY ACTIVITY, COMPOSITIONS, AND USES THEREOF EGLN2, EGLN3, HIF1AN ABCB11 3311/4885CYP1A2 122/4885CYP3A4 648/4885
US-20090093483-A1 Naphthalenone compounds exhibiting prolyl hydroxylase inhibitory activity, compositions, and uses thereof EGLN2, EGLN3, HIF1AN ABCB11 3311/4885CYP1A2 122/4885CYP3A4 648/4885

“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.

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