SCHEMBL1002731

SCHEMBL1002731

O=C1CCCC2=C1C(c1ccc(Cl)c(Cl)c1)C1=C(CCCC1=O)N2

nearest known ligand 0.73

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ ABCC9 O60706 15/20 0.73
▸ ABCC8 Q09428 15/20 0.73
▸ KCNJ11 Q14654 15/20 0.73
▸ KCNJ8 Q15842 15/20 0.73
▸ KDM4E B2RXH2 2/20 0.55
▸ GAA P10253 1/20 0.55
▸ HSD17B10 Q99714 1/20 0.55
▸ ALDH1A1 P00352 2/20 0.53
▸ GPR174 Q9BXC1 1/20 0.52
▸ KMT2A Q03164 1/20 0.50

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
SCHEMBL6929871 0.91 ABCC9 (0.62) ABCC9ABCC8KCNJ11KCNJ8KDM4E
SCHEMBL7833345 0.87 ABCC9 (0.75) ABCC9ABCC8KCNJ11KCNJ8
SCHEMBL6909541 0.86 ABCC9 (0.61) ABCC9ABCC8KCNJ11KCNJ8KDM4E
SCHEMBL6432083 0.86 ABCC9 (0.61) ABCC9ABCC8KCNJ11KCNJ8KDM4E
SCHEMBL6903824 0.86 ABCC9 (0.61) ABCC9ABCC8KCNJ11KCNJ8KDM4E
SCHEMBL6903919 0.86 ABCC9 (0.61) ABCC9ABCC8KCNJ11KCNJ8KDM4E
SCHEMBL7239344 0.85 ABCC9 (1.00) ABCC9ABCC8KCNJ11KCNJ8
SCHEMBL15450449 0.84 GPR174 (0.71) GAAGPR174KMT2A
SCHEMBL7817092 0.83 GPR174 (0.70) ABCC9ABCC8KCNJ11KCNJ8KDM4E
SCHEMBL7820651 0.83 ABCC9 (0.63) ABCC9ABCC8KCNJ11KCNJ8KDM4E

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-20110118174-A1 TREATMENT SOLUTION AND METHOD FOR PREVENTING POSTERIOR CAPSULAR OPACIFICATION BY SELECTIVELY INDUCING DETACHMENT AND/OR DEATH OF LENS EPITHELIAL CELLS ZHANG JINJUN 2011-05-19 — — US disclosed
US-7875270-B2 Ion transport mechanism interference agent is capable of interfering with the cellular mechanisms of lens epithelial cells while leaving other ocular cells unharmed Abbott Medical Optics Inc. (US) 2011-01-25 — — US disclosed
US-20090012067-A1 Modulation of Hypothalamic Atp-Sensitive Potassium Channels ALBERT EINSTEIN COLLEGE OF MEDICINE, INC. 2009-01-08 — — US disclosed
US-20090012067-A1 Modulation of Hypothalamic Atp-Sensitive Potassium Channels ALBERT EINSTEIN COLLEGE OF MEDICINE, INC. 2009-01-08 — — US disclosed
US-20090012067-A1 Modulation of Hypothalamic Atp-Sensitive Potassium Channels ALBERT EINSTEIN COLLEGE OF MEDICINE, INC. 2009-01-08 — — US disclosed
US-20070026079-A1 Intranasal administration of modulators of hypothalamic ATP-sensitive potassium channels DARA BIOSCIENCES, INC. 2007-02-01 — — US disclosed
US-20070026079-A1 Intranasal administration of modulators of hypothalamic ATP-sensitive potassium channels DARA BIOSCIENCES, INC. 2007-02-01 — — US disclosed
US-20070026079-A1 Intranasal administration of modulators of hypothalamic ATP-sensitive potassium channels DARA BIOSCIENCES, INC. 2007-02-01 — — US disclosed
US-20050159410-A1 Treatment solution and method for preventing posterior capsular opacification by selectively inducing detachment and/or death of lens epithelial cells ZHANG, JIN JUN (CN) 2005-07-21 — — 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-20090012067-A1 Modulation of Hypothalamic Atp-Sensitive Potassium Channels PYGB, PC, KCNN3 ABCC9 384/4885ABCC8 415/4885KCNJ11 18/4885
US-20070026079-A1 Intranasal administration of modulators of hypothalamic ATP-sensitive potassium channels PC, LIPE, ATP5ME ABCC9 482/4885ABCC8 605/4885KCNJ11 24/4885

“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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