SCHEMBL2415883

SCHEMBL2415883

Nc1ccccc1NC(=O)c1ccc(CNC(=O)c2cccnc2)cc1

nearest known ligand 0.74

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 19/20 0.74
HDAC3 O15379 5/20 0.74
HDAC2 Q92769 5/20 0.74
HDAC11 Q96DB2 4/20 0.70
HDAC8 Q9BY41 4/20 0.70
HDAC6 Q9UBN7 4/20 0.70
HDAC4 P56524 3/20 0.70
HDAC7 Q8WUI4 3/20 0.70
HDAC10 Q969S8 3/20 0.70
HDAC9 Q9UKV0 3/20 0.70
HDAC5 Q9UQL6 3/20 0.70
NCOR2 Q9Y618 3/20 0.70
CYP3A4 P08684 2/20 0.70
KDM1A O60341 1/20 0.70
F3 P13726 1/20 0.70
NAMPT P43490 3/20 0.68
NCOR1 O75376 1/20 0.62

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
SCHEMBL2411366 0.89 HDAC1 (0.69) HDAC1HDAC3HDAC2HDAC11HDAC8
SCHEMBL2411669 0.88 HDAC1 (0.69) HDAC1HDAC3HDAC2HDAC11HDAC8
SCHEMBL6243828 0.88 HDAC1 (0.76) HDAC1HDAC3HDAC2HDAC11HDAC8
SCHEMBL2412421 0.87 HDAC1 (0.84) HDAC1HDAC3HDAC2HDAC11HDAC8
SCHEMBL2409953 0.87 HDAC1 (0.67) HDAC1HDAC3HDAC2HDAC11HDAC8
Hydrochloric Acid SCHEMBL1435432 0.86 HDAC1 (0.74) HDAC1HDAC3HDAC2HDAC11HDAC8
SCHEMBL18086514 0.86 HDAC1 (1.00) HDAC1HDAC3HDAC2HDAC11HDAC8
SCHEMBL2413513 0.85 HDAC1 (0.77) HDAC1HDAC3HDAC2HDAC11HDAC8
SCHEMBL2413570 0.85 HDAC1 (0.80) HDAC1HDAC3HDAC2HDAC11HDAC8
SCHEMBL2414810 0.85 HDAC1 (0.71) HDAC1HDAC3HDAC2HDAC11HDAC8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150374646-A1 TREATMENT OF CANCER AND OTHER CONDITIONS USING A TRANSCRIPTION FACTOR MODULATOR C & C BIOPHARMA LLC (US) 2015-12-31 US disclosed
WO-2014138505-A1 TREATMENT OF CANCER AND OTHER CONDITIONS USING A TRANSCRIPTION FACTOR MODULATOR C & C BIOPHARMA, LLC (US) 2014-09-12 WO disclosed
US-20140256776-A1 TREATMENT OF CANCER AND OTHER CONDITIONS USING A TRANSCRIPTION FACTOR MODULATOR C&C BIOPHARMA, LLC 2014-09-11 US disclosed
US-8026239-B2 Cell differentiation inducer BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2011-09-27 US disclosed
US-20100256201-A1 CELL DIFFERENTIATION INDUCER BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2010-10-07 US disclosed
US-7687525-B2 Cell differentiation inducer BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2010-03-30 US disclosed
US-RE40703-E1 Cell differentiation inducer, benzamide compounds SCHERING AKTIENGESELLSCHAFT (DE) 2009-04-28 US disclosed
US-20080188489-A1 Cell differentiation inducer SCHERING AKTIENGESELLSCHAFT (DE) 2008-08-07 US disclosed
US-7317028-B2 Cell differentiation inducer SCHERING AKTIENGESELLSCHAFT (DE) 2008-01-08 US disclosed
US-RE39754-E1 Benzamide derivatives and pharmaceutical compositions containing same SCHERING AG (DE) 2007-07-31 US disclosed
EP-1738752-A1 Pharmaceutical combinations comprising cis-retine acid Schering Aktiengesellschaft (DE) 2007-01-03 EP disclosed
EP-1641458-A2 PHARMACEUTICAL COMBINATIONS OF PHTHALAZINE VEGF INHIBITORS AND BENZAMIDE HDAC INHIBITORS SCHERING AKTIENGESELLSCHAFT (DE) 2006-04-05 EP disclosed
US-20050054647-A1 New pharmaceutical combination BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2005-03-10 US disclosed
US-6794392-B1 Cell differentiation inducer SCHERING AKTIENGESELLSCHAFT (DE) 2004-09-21 US disclosed
US-20040147569-A1 Antitumor agents; autoimmune disease; skin disorders; anticancer agents SCHERING AKTIENGESELLSCHAFT 2004-07-29 US disclosed
WO-2004058234-A2 PHARMACEUTICAL COMBINATIONS OF PHTHALAZINE VEGF INHIBITORS AND BENZAMIDE HDAC INHIBITORS SCHERING AKTIENGESELLSCHAFT (DE) 2004-07-15 WO disclosed
EP-1437346-A1 Benzamide derivatives useful as cell differentiation inducers Schering AG (DE) 2004-07-14 EP disclosed
EP-0847992-B1 Benzamide derivatives, useful as cell differentiation inducers SCHERING AG (DE) 2004-06-23 EP disclosed
US-6174905-B1 AS CARCINOSTATIC AGENT TO A HEMATOLOGIC MALIGNANCY AND A SOLID CARCINOMA MITSUI CHEMICALS, INC. (JP) 2001-01-16 US disclosed
EP-0847992-A1 Benzamide derivatives, useful as cell differentiation inducers Mitsui Chemicals, Inc. (JP) 1998-06-17 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 (6 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-20080188489-A1 Cell differentiation inducer MCL1, MYADM, MYD88 HDAC1 150/4885HDAC3 618/4885HDAC2 170/4885
US-20040147569-A1 Antitumor agents; autoimmune disease; skin disorders; anticancer agents MCL1, MYADM, PDCD1 HDAC1 81/4885HDAC3 807/4885HDAC2 204/4885
US-20100256201-A1 CELL DIFFERENTIATION INDUCER MCL1, MYADM, MYD88 HDAC1 163/4885HDAC3 680/4885HDAC2 183/4885
US-20140256776-A1 TREATMENT OF CANCER AND OTHER CONDITIONS USING A TRANSCRIPTION FACTOR MODULATOR RELA, NCOA1, NCOA2 HDAC1 163/4885HDAC3 287/4885HDAC2 290/4885
US-20050054647-A1 New pharmaceutical combination VEGFA, INHA, PGF HDAC1 976/4885HDAC3 1616/4885HDAC2 1101/4885
US-20150374646-A1 TREATMENT OF CANCER AND OTHER CONDITIONS USING A TRANSCRIPTION FACTOR MODULATOR RELA, NCOA1, NCOA2 HDAC1 163/4885HDAC3 287/4885HDAC2 290/4885

“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.