Naphthoquinone

Naphthoquinone

SCHEMBL2208241

Br.O=C1C=CC(=O)c2ccccc21

nearest known ligand 0.93

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Known targets — ChEMBL curated mechanism

ACHEADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB1ADRB2ADRB3APH1AAPH1BCHRM2CHRM3EZH2GRIN2AHTR1AHTR1BHTR1DHTR1FHTR3ANCSTNP2RY12PSEN1PSEN2PSENENSIGMAR1SLC6A2SLC6A3SLC6A4

The experimentally established mechanism targets of Naphthoquinone. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ACHE known ✓ P22303 1/20 0.52
▸ CDC25B P30305 6/20 0.93
▸ IDO1 P14902 6/20 0.93
▸ MAOA P21397 3/20 0.93
▸ PIN1 Q13526 2/20 0.93
▸ EHMT2 Q96KQ7 2/20 0.93
▸ MAOB P27338 2/20 0.93
▸ SNCA P37840 2/20 0.93
▸ AKT1 P31749 1/20 0.93
▸ MAP2K1 Q02750 1/20 0.93
▸ NSD1 Q96L73 1/20 0.93
▸ EHMT1 Q9H9B1 1/20 0.93
▸ MEN1 O00255 7/20 0.52
▸ KMT2A Q03164 7/20 0.52
▸ ALDH1A1 P00352 6/20 0.52
▸ MAPT P10636 5/20 0.52
▸ HPGD P15428 5/20 0.52
▸ RECQL P46063 4/20 0.52
▸ KDM4E B2RXH2 4/20 0.52
▸ ALOX15 P16050 4/20 0.52

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
Naphthoquinone SCHEMBL14764194 0.97 CDC25B (0.88) CDC25BIDO1MAOAPIN1EHMT2
Naphthoquinone SCHEMBL11359780 0.97 IDO1 (1.00) CDC25BIDO1MAOAPIN1EHMT2
Naphthoquinone SCHEMBL8861335 0.97 IDO1 (1.00) CDC25BIDO1MAOAPIN1EHMT2
Naphthoquinone SCHEMBL29354680 0.97 IDO1 (1.00) CDC25BIDO1MAOAPIN1EHMT2
Naphthoquinone SCHEMBL42139 0.97 IDO1 (1.00) CDC25BIDO1MAOAPIN1EHMT2
Naphthoquinone SCHEMBL11229112 0.93 IDO1 (0.93) CDC25BIDO1MAOAPIN1EHMT2
Naphthoquinone SCHEMBL2722901 0.93 IDO1 (0.93) CDC25BIDO1MAOAPIN1EHMT2
Naphthoquinone SCHEMBL11341909 0.93 IDO1 (0.93) CDC25BIDO1MAOAPIN1EHMT2
Naphthoquinone SCHEMBL9262622 0.93 IDO1 (0.93) CDC25BIDO1MAOAPIN1EHMT2
Naphthoquinone SCHEMBL14763779 0.93 IDO1 (0.93) CDC25BIDO1MAOAPIN1EHMT2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3018116-B1 VITAMIN K2 INTERMEDIATES KAPPA BIOSCIENCE AS (NO) 2020-10-28 — — EP disclosed
US-10472314-B2 Process for the preparation of vitamin K2 KAPPA BIOSCIENCE AS (NO) 2019-11-12 — — US disclosed
US-20170283354-A1 PROCESS FOR THE PREPARATION OF VITAMIN K2 KAPPA BIOSCIENCE AS (NO) 2017-10-05 — — US disclosed
EP-3018116-A1 VITAMIN K2 INTERMEDIATES Kappa Bioscience As (NO) 2016-05-11 — — EP disclosed
EP-2346806-B1 PROCESS FOR THE PREPARATION OF VITAMIN K2 KAPPA BIOSCIENCE AS (NO) 2016-01-06 — — EP disclosed
US-20150210620-A1 PROCESS FOR THE PREPARATION OF VITAMIN K2 KAPPA BIOSCIENCE AS (NO) 2015-07-30 — — US disclosed
US-9012693-B2 Process for the preparation of vitamin K2 KAPPA BIOSCIENCE AS (NO) 2015-04-21 — — US disclosed
WO-2011117324-A2 PROCESS FOR THE PREPARATION OF VITAMIN K2 KAPPA BIOSCIENCE AS (NO) 2011-09-29 — — WO disclosed
US-20110207967-A1 PROCESS FOR THE PREPARATION OF VITAMIN K2 KAPPA BIOSCIENCE AS (NO) 2011-08-25 — — US disclosed
EP-2346806-A1 PROCESS FOR THE PREPARATION OF VITAMIN K2 Kappa Bioscience As (NO) 2011-07-27 — — EP disclosed
WO-2010035000-A1 PROCESS FOR THE PREPARATION OF VITAMIN K2 KAPPA BIOSCIENCE AS (NO) 2010-04-01 — — 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 (4 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-10472314-B2 Process for the preparation of vitamin K2 PROC, VKORC1, VKORC1L1 ACHE 2118/4885CDC25B 2162/4885IDO1 2104/4885
US-20170283354-A1 PROCESS FOR THE PREPARATION OF VITAMIN K2 PROC, VKORC1, VKORC1L1 ACHE 2316/4885CDC25B 2456/4885IDO1 2303/4885
US-20110207967-A1 PROCESS FOR THE PREPARATION OF VITAMIN K2 PROC, VKORC1, VKORC1L1 ACHE 2186/4885CDC25B 2346/4885IDO1 2327/4885
US-20150210620-A1 PROCESS FOR THE PREPARATION OF VITAMIN K2 PROC, VKORC1, VKORC1L1 ACHE 2316/4885CDC25B 2456/4885IDO1 2303/4885

“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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