SCHEMBL449253

SCHEMBL449253

COc1cc2c(c(-c3cc(C)cc(C)c3)c1OC)CN(Cc1ccc(C(=O)Nc3ccccc3N)cc1)C2=O

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 18/20 0.57
HDAC3 O15379 5/20 0.57
HDAC2 Q92769 5/20 0.57
HDAC4 P56524 2/20 0.57
HDAC7 Q8WUI4 2/20 0.57
HDAC6 Q9UBN7 2/20 0.46
NCOR1 O75376 1/20 0.46
HDAC10 Q969S8 1/20 0.46
HDAC11 Q96DB2 1/20 0.46
HDAC8 Q9BY41 1/20 0.46
HDAC9 Q9UKV0 1/20 0.46
HDAC5 Q9UQL6 1/20 0.46
TUBB4A P04350 1/20 0.44
TUBB P07437 1/20 0.44
TUBA3C P0DPH7 1/20 0.44
TUBA1B P68363 1/20 0.44
TUBA4A P68366 1/20 0.44
TUBB4B P68371 1/20 0.44
TUBB3 Q13509 1/20 0.44
TUBB2A Q13885 1/20 0.44

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
SCHEMBL447722 0.93 HDAC1 (0.59) HDAC1HDAC3HDAC2HDAC4HDAC7
SCHEMBL446646 0.91 HDAC1 (0.56) HDAC1HDAC3HDAC2HDAC4HDAC7
SCHEMBL449407 0.91 HDAC1 (0.56) HDAC1HDAC3HDAC2HDAC4HDAC7
SCHEMBL452316 0.89 HDAC1 (0.55) HDAC1HDAC3HDAC2HDAC4HDAC7
SCHEMBL447230 0.88 HDAC1 (0.54) HDAC1HDAC3HDAC2HDAC4HDAC7
SCHEMBL448060 0.88 HDAC1 (0.53) HDAC1HDAC3HDAC2HDAC4HDAC7
SCHEMBL449975 0.86 HDAC1 (0.61) HDAC1HDAC3HDAC2HDAC4HDAC7
SCHEMBL450368 0.85 HDAC1 (0.61) HDAC1HDAC3HDAC2HDAC4HDAC7
SCHEMBL450287 0.83 HDAC1 (0.67) HDAC1HDAC3HDAC2HDAC4HDAC7
SCHEMBL449565 0.81 HDAC1 (0.56) HDAC1HDAC3HDAC2HDAC4HDAC7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8716326-B2 Isoindolinone derivatives, preparation method thereof and a pharmaceutical composition comprising same KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 2014-05-06 US claimed
EP-2429987-A2 AMIDE COMPOUND, PREPARATION METHOD THEREOF AND PHARMACEUTICAL COMPOSITION COMPRISING SAME Korea Research Institute Of Chemical Technology (KR) 2012-03-21 EP claimed
US-20120065396-A1 ISOINDOLINONE DERIVATIVES, PREPARATION METHOD THEREOF AND A PHARMACEUTICAL COMPOSITION COMPRISING SAME KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 2012-03-15 US claimed
WO-2010131922-A2 AMIDE COMPOUND, PREPARATION METHOD THEREOF AND PHARMACEUTICAL COMPOSITION COMPRISING SAME KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 2010-11-18 WO claimed
US-9850353-B2 Articles and armor materials incorporating fiber-free compositions and methods of forming same ORBITAL ATK, INC. (US) 2017-12-26 US disclosed
US-20150361229-A1 ARTICLES AND ARMOR MATERIALS INCORPORATING FIBER-FREE COMPOSITIONS AND METHODS OF FORMING SAME NORTHROP GRUMMAN SYSTEMS CORPORATION 2015-12-17 US disclosed
US-8716326-B2 Isoindolinone derivatives, preparation method thereof and a pharmaceutical composition comprising same KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 2014-05-06 US disclosed
EP-2429987-A2 AMIDE COMPOUND, PREPARATION METHOD THEREOF AND PHARMACEUTICAL COMPOSITION COMPRISING SAME Korea Research Institute Of Chemical Technology (KR) 2012-03-21 EP disclosed
US-20120065294-A1 INSULATIVE COMPOSITIONS, ARTICLE INCORPORATING THE SAME AND METHODS OF FORMING THE SAME ALLIANT TECHSYSTEMS INC. (US) 2012-03-15 US disclosed
US-20120065396-A1 ISOINDOLINONE DERIVATIVES, PREPARATION METHOD THEREOF AND A PHARMACEUTICAL COMPOSITION COMPRISING SAME KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 2012-03-15 US disclosed
WO-2010131922-A2 AMIDE COMPOUND, PREPARATION METHOD THEREOF AND PHARMACEUTICAL COMPOSITION COMPRISING SAME KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 2010-11-18 WO disclosed
EP-1373386-B1 FIBER-REINFORCED ROCKET MOTOR INSULATION ALLIANT TECHSYSTEMS INC (US) 2006-08-16 EP disclosed
US-7070705-B2 Fiber-reinforced rocket motor insulation ALLIANT TECHSYSTEMS INC. (US) 2006-07-04 US disclosed
US-20040157979-A1 Fiber-reinforced rocket motor insulation NORTHROP GRUMMAN SYSTEMS CORPORATION 2004-08-12 US disclosed
WO-2002079307-A9 FIBER-REINFORCED ROCKET MOTOR INSULATION ALLIANT TECHSYSTEMS INC (US) 2004-05-06 WO disclosed
US-6691505-B2 Fiber-reinforced rocket motor insulation ALLIANT TECHSYSTEMS INC. 2004-02-17 US disclosed
EP-1373386-A2 FIBER-REINFORCED ROCKET MOTOR INSULATION Alliant Techsystems Inc. (US) 2004-01-02 EP disclosed
US-20020189233-A1 Fiber-reinforced rocket motor insulation NORTHROP GRUMMAN SYSTEMS CORPORATION 2002-12-19 US disclosed
WO-2002079307-A2 FIBER-REINFORCED ROCKET MOTOR INSULATION ALLIANT TECHSYSTEMS INC. (US) 2002-10-10 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 (1 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-20120065396-A1 ISOINDOLINONE DERIVATIVES, PREPARATION METHOD THEREOF AND A PHARMACEUTICAL COMPOSITION COMPRISING SAME PPIP5K2, SOST, ALPL HDAC1 761/4885HDAC3 638/4885HDAC2 641/4885

“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.