SCHEMBL1828053

SCHEMBL1828053

Cc1cc(OCCCl)ccc1[N+](=O)[O-]

nearest known ligand 0.64

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 4/20 0.64
▸ KDM4E B2RXH2 4/20 0.56
▸ MEN1 O00255 3/20 0.55
▸ KMT2A Q03164 3/20 0.55
▸ HTT P42858 1/20 0.55
▸ ALDH1A1 P00352 6/20 0.54
▸ SMN1; SMN2 Q16637 4/20 0.53
▸ NPC1 O15118 3/20 0.53
▸ RAB9A P51151 3/20 0.53
▸ MAPK1 P28482 1/20 0.52
▸ LMNA P02545 2/20 0.50
▸ GAA P10253 1/20 0.48
▸ L3MBTL1 Q9Y468 1/20 0.48

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
SCHEMBL10870559 0.90 MAPT (0.71) MAPTKDM4EMEN1KMT2AHTT
SCHEMBL11643791 0.89 MAPT (0.78) MAPTKDM4EMEN1KMT2AHTT
SCHEMBL11439028 0.88 MAPT (0.50) MAPTKDM4EMEN1KMT2AHTT
SCHEMBL4835421 0.86 MAPT (0.70) MAPTKDM4EMEN1KMT2AHTT
SCHEMBL1141920 0.86 MAPT (0.70) MAPTKDM4EMEN1KMT2AHTT
SCHEMBL5453599 0.84 MAPT (0.64) MAPTKDM4EMEN1KMT2AHTT
SCHEMBL14333508 0.84 MAPT (0.64) MAPTKDM4EMEN1KMT2AHTT
SCHEMBL16025774 0.84 MAPT (0.64) MAPTKDM4EMEN1KMT2AHTT
SCHEMBL8746685 0.83 MAPT (0.62) MAPTKDM4EMEN1KMT2AHTT
SCHEMBL10341874 0.83 MAPT (0.67) MAPTKDM4EMEN1KMT2AHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-RE48140-E1 Furanone derivative CARNA BIOSCIENCES, INC. (JP) 2020-08-04 — — US disclosed
EP-2692728-B1 NOVEL FURANONE DERIVATIVE CARNA BIOSCIENCES INC (JP) 2018-07-04 — — EP disclosed
US-RE46815-E1 Furanone derivative CARNA BIOSCIENCES, INC. (JP) 2018-05-01 — — US disclosed
US-8742113-B2 Furanone derivative SBI BIOTECH CO., LTD. (JP) 2014-06-03 — — US disclosed
EP-2692728-A1 NOVEL FURANONE DERIVATIVE SBI Biotech Co., Ltd. (JP) 2014-02-05 — — EP disclosed
US-20140018533-A1 NOVEL FURANONE DERIVATIVE CARNA BIOSCIENCES, INC. (JP) 2014-01-16 — — US disclosed
CN-102171190-A Insecticidal benzenedicarboxamide derivative BAYER CROPSCIENCE AG 2011-08-31 — — CN disclosed
US-20110184188-A1 Insecticidal Benzenedicarboxamide Derivative BAYER CROPSCIENCE AG (DE) 2011-07-28 — — US disclosed
EP-2318374-A2 INSECTICIDAL BENZENEDICARBOXAMIDE DERIVATIVE Bayer CropScience AG (DE) 2011-05-11 — — EP disclosed
WO-2010012442-A2 INSECTICIDAL BENZENEDICARBOXAMIDE DERIVATIVE BAYER CROPSCIENCE AG (DE) 2010-02-04 — — WO disclosed
EP-0569380-B1 ACRIDINE DERIVATIVES GLAXO LAB SA (FR) 1997-05-28 — — EP disclosed
US-5604237-A IMPROVE OR INCREASE EFFICACY OF ANTITUMOR AGENT, INCREASE OR RESTORE SENSITIVITY OF TUMOR TO ANTITUMOR AGENT, REVERSE OR REDUCE RESISTANCE OF TUMOR TO ANTITUMOR AGENT LABORATOIRES GLAXO SA (FR) 1997-02-18 — — US disclosed
EP-0494623-A1 Acridine derivatives LABORATOIRES GLAXO SA (FR) 1992-07-15 — — EP 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-20140018533-A1 NOVEL FURANONE DERIVATIVE CYP11B1, OXER1, CYP11B2 MAPT 4591/4885KDM4E 1886/4885MEN1 427/4885
US-20110184188-A1 Insecticidal Benzenedicarboxamide Derivative DDT, BRD9, BCL2A1 MAPT 4079/4885KDM4E 346/4885MEN1 4180/4885

“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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