SCHEMBL4029206

SCHEMBL4029206

O=C(/C=C/c1ccccc1)NC(=O)/C=C/c1ccccc1

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC2 Q92769 3/20 0.76
HDAC3 O15379 2/20 0.76
HDAC4 P56524 2/20 0.76
HDAC1 Q13547 2/20 0.76
HDAC8 Q9BY41 2/20 0.76
HDAC6 Q9UBN7 2/20 0.76
HTT P42858 1/20 0.72
KMT2A Q03164 3/20 0.69
MMP1 P03956 5/20 0.68
MMP2 P08253 5/20 0.68
MMP9 P14780 5/20 0.68
EGFR P00533 2/20 0.68
MAOA P21397 1/20 0.68
MAOB P27338 1/20 0.68
MAPT P10636 2/20 0.66
TDP1 Q9NUW8 2/20 0.66
NPC1 O15118 2/20 0.66
RAB9A P51151 2/20 0.66
RECQL P46063 2/20 0.64
ALDH1A1 P00352 2/20 0.64

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
SCHEMBL29060766 1.00 HDAC2 (0.76) HDAC2HDAC3HDAC4HDAC1HDAC8
SCHEMBL28440928 0.93 HDAC2 (0.73) HDAC2HDAC3HDAC4HDAC1HDAC8
SCHEMBL28440927 0.93 HDAC2 (0.73) HDAC2HDAC3HDAC4HDAC1HDAC8
SCHEMBL7663174 0.90 HDAC3 (0.63) HDAC2HDAC3HDAC4HDAC1HDAC8
SCHEMBL7656834 0.90 HDAC2 (0.63) HDAC2HDAC3HDAC4HDAC1HDAC8
SCHEMBL9782058 0.88 HDAC2 (0.66) HDAC2HDAC3HDAC4HDAC1HDAC8
SCHEMBL15121430 0.88 HDAC2 (0.66) HDAC2HDAC3HDAC4HDAC1HDAC8
SCHEMBL6829701 0.88 HTT (0.74) HDAC2HDAC3HDAC4HDAC1HDAC8
SCHEMBL15121428 0.88 HDAC2 (0.66) HDAC2HDAC3HDAC4HDAC1HDAC8
SCHEMBL9782051 0.88 HDAC2 (0.66) HDAC2HDAC3HDAC4HDAC1HDAC8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1299388-B1 VARIOLIN DERIVATIVES AS ANTI-CANCER AGENTS PHARMA MAR SA (ES) 2009-05-13 EP claimed
US-7320981-B2 Antitumor agents PHARMA MAR, S.A. (ES) 2008-01-22 US claimed
US-20050014778-A1 Variolin derivatives as anti-cancer agents PHARMA MAR, S.A. (ES) 2005-01-20 US claimed
EP-1299388-A1 VARIOLIN DERIVATIVES AS ANTI-CANCER AGENTS PHARMA MAR, S.A. (ES) 2003-04-09 EP claimed
WO-2002004447-A1 VARIOLIN DERIVATIVES AS ANTI-CANCER AGENTS PHARMA MAR, S.A. (ES) 2002-01-17 WO claimed
CN-116606247-A Imide compound and preparation method and application thereof 温州医科大学 2023-08-18 CN disclosed
EP-1299388-B1 VARIOLIN DERIVATIVES AS ANTI-CANCER AGENTS PHARMA MAR SA (ES) 2009-05-13 EP disclosed
US-7320981-B2 Antitumor agents PHARMA MAR, S.A. (ES) 2008-01-22 US disclosed
US-7094516-B2 Benzobisazole compound and optical recording medium containing the compound MITSUI CHEMICALS, INC. (JP) 2006-08-22 US disclosed
EP-1247655-B1 OPTICAL RECORDING MEDIUM AND NOVEL AZAPORPHYRIN COMPOUNDS MITSUI CHEMICALS INC (JP) 2006-05-31 EP disclosed
US-20060088786-A1 Rewritable optical information recording medium, recording and reproducing methods, as well as recording and reproducing apparatus MITSUI CHEMICALS, INC. (JP) 2006-04-27 US disclosed
EP-1262966-B1 Optical recording medium and novel azaporphyrin compound MITSUI CHEMICALS INC (JP) 2006-04-12 EP disclosed
US-6627288-B1 Optical recording medium and porphycene compound MITSUI CHEMICALS, INC. (JP) 2003-09-30 US disclosed
US-20030091931-A1 Benzbisazole compound and optical recording medium containing the compound MITSUI CHEMICALS, INC. (JP) 2003-05-15 US disclosed
EP-1299388-A1 VARIOLIN DERIVATIVES AS ANTI-CANCER AGENTS PHARMA MAR, S.A. (ES) 2003-04-09 EP disclosed
EP-1262966-A2 Optical recording medium and novel azaporphyrin compound Mitsui Chemicals, Inc. (JP) 2002-12-04 EP disclosed
EP-1247655-A1 OPTICAL RECORDING MEDIUM AND NOVEL AZAPORPHYRIN COMPOUNDS Mitsui Chemicals, Inc. (JP) 2002-10-09 EP disclosed
EP-1245571-A1 BENZBISAZOLE COMPOUND AND OPTICAL RECORDING MEDIUM CONTAINING THE COMPOUND Mitsui Chemicals, Inc. (JP) 2002-10-02 EP disclosed
EP-1180765-A1 Optical recording medium and porphycene compound Mitsui Chemicals, Inc. (JP) 2002-02-20 EP disclosed
WO-2002004447-A1 VARIOLIN DERIVATIVES AS ANTI-CANCER AGENTS PHARMA MAR, S.A. (ES) 2002-01-17 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 (3 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-20030091931-A1 Benzbisazole compound and optical recording medium containing the compound DAO, CACNA1I, KCNB2 HDAC2 2522/4885HDAC3 2148/4885HDAC4 2865/4885
US-20050014778-A1 Variolin derivatives as anti-cancer agents CBR3, CCNL2, CBR1 HDAC2 251/4885HDAC3 175/4885HDAC4 715/4885
US-20060088786-A1 Rewritable optical information recording medium, recording and reproducing methods, as well as recording and reproducing apparatus ALPG, TRPC6, GNRHR HDAC2 3227/4885HDAC3 4298/4885HDAC4 4289/4885

“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.