SCHEMBL2175904

SCHEMBL2175904

COC(=O)N(Cc1ccc(C(=O)Nc2ccccc2N)cc1)c1cccnc1

nearest known ligand 0.59

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 20/20 0.59
HDAC3 O15379 7/20 0.59
HDAC2 Q92769 7/20 0.59
NCOR2 Q9Y618 4/20 0.59
HDAC11 Q96DB2 5/20 0.55
HDAC8 Q9BY41 5/20 0.55
HDAC6 Q9UBN7 5/20 0.55
HDAC4 P56524 4/20 0.55
HDAC7 Q8WUI4 4/20 0.55
HDAC10 Q969S8 4/20 0.55
HDAC9 Q9UKV0 4/20 0.55
HDAC5 Q9UQL6 4/20 0.55
CYP3A4 P08684 2/20 0.55
KDM1A O60341 1/20 0.55
F3 P13726 1/20 0.55
NAMPT P43490 2/20 0.52
NCOR1 O75376 1/20 0.51

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
SCHEMBL30006351 1.00 HDAC1 (0.59) HDAC1HDAC3HDAC2NCOR2HDAC11
Bromide SCHEMBL3943842 0.99 HDAC1 (0.58) HDAC1HDAC3HDAC2NCOR2HDAC11
Hydrochloric Acid SCHEMBL3943756 0.99 HDAC1 (0.58) HDAC1HDAC3HDAC2NCOR2HDAC11
Acetic Acid SCHEMBL4103112 0.97 HDAC1 (0.59) HDAC1HDAC3HDAC2NCOR2HDAC11
Phosphoric Acid SCHEMBL3948469 0.97 HDAC1 (0.56) HDAC1HDAC3HDAC2NCOR2HDAC11
SCHEMBL3940281 0.96 HDAC1 (0.55) HDAC1HDAC3HDAC2NCOR2HDAC11
Sulfuric Acid SCHEMBL3948204 0.96 HDAC1 (0.55) HDAC1HDAC3HDAC2NCOR2HDAC11
Succinic Acid SCHEMBL3948465 0.95 HDAC1 (0.57) HDAC1HDAC3HDAC2NCOR2HDAC11
Lactic Acid SCHEMBL3937225 0.94 HDAC1 (0.56) HDAC1HDAC3HDAC2NCOR2HDAC11
Fumaric Acid SCHEMBL3941169 0.94 HDAC1 (0.56) HDAC1HDAC3HDAC2NCOR2HDAC11

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
CN-108883179-A Histone deacetylase inhibitor is used to enhance the purposes of immunization therapy 印第安纳大学研究与技术公司 2018-11-23 CN claimed
US-20250064925-A1 METHOD OF TREATING CANCER USING A COMBINATION OF ENTINOSTAT AND AN ANTI-CSF-1R ANTIBODY SYNDAX PHARMACEUTICALS, INC. 2025-02-27 US disclosed
US-20240398944-A1 COMBINATION OF HDAC INHIBITOR AND ANTI-PD-1 ANTIBODY FOR TREATMENT OF CANCER SYNDAX PHARMACEUTICALS, INC. 2024-12-05 US disclosed
CN-117881660-A New forms of entinostat and maleic or succinic acid 麦克法伦史密斯有限公司 2024-04-12 CN disclosed
CN-116893262-A Patient Selection for Combination Therapy 赛达克斯制药股份有限公司 2023-10-17 CN disclosed
CN-108139403-B Patient selection for combination therapy 赛达克斯制药股份有限公司 2023-05-09 CN disclosed
CN-114053284-A Methods of treating breast cancer 辛达克斯制药股份有限公司 2022-02-18 CN disclosed
CN-112513636-A Selection of patients for combination therapy 赛达克斯制药股份有限公司 2021-03-16 CN disclosed
CN-111278459-A Combination therapy 赛达克斯制药股份有限公司 2020-06-12 CN disclosed
CN-110944978-A Compound containing entinostat, compound crystal form thereof, preparation method and pharmaceutical composition 杭州领业医药科技有限公司 2020-03-31 CN disclosed
CN-110446504-A With the antibody combined epigenetic modulators for treatment cancer of brain signal protein-4 D VACCINEX INC 2019-11-12 CN disclosed
CN-108883179-A Histone deacetylase inhibitor is used to enhance the purposes of immunization therapy 印第安纳大学研究与技术公司 2018-11-23 CN disclosed
CN-108430472-A Combination for the hdac inhibitor and anti-PD-L1 antibody for the treatment of oophoroma 赛达克斯制药股份有限公司 2018-08-21 CN disclosed
US-RE45499-E1 N-(2-aminophenyl)-4-[N-(pyridine-3-yl)-methoxycarbonyl-aminomethyl]-benzamide (MS-275) polymorph B BAYER INTELLECTUAL PROPERTY GMBH (DE) 2015-04-28 US disclosed
EP-2350005-B1 N-(2-AMINOPHENYL)-4-[N-(PYRIDINE-3-YL)-METHOXYCARBONYL-AMINOMETHYL]-BENZAMIDE (MS-275)POLYMORPH B Bayer Pharma AG (DE) 2011-12-21 EP disclosed
EP-2350005-A1 N-(2-AMINOPHENYL)-4-[N-(PYRIDINE-3-YL)-METHOXYCARBONYL-AMINOMETHYL]-BENZAMIDE (MS-275)POLYMORPH B Bayer Schering Pharma Aktiengesellschaft (DE) 2011-08-03 EP disclosed
US-7973166-B2 N-(2-aminophenyl)-4-[N-(pyridine-3-yl)-methoxycarbonyl-aminomethyl]-benzamide (MS-275) polymorph B BAYER SCHERING PHARMA AG (DE) 2011-07-05 US disclosed
WO-2010022988-A1 N-(2-AMINOPHENYL)-4-[N-(PYRIDINE-3-YL)-METHOXYCARBONYL-AMINOMETHYL]-BENZAMIDE (MS-275)POLYMORPH B BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2010-03-04 WO disclosed
US-20100056585-A1 N-(2-Aminophenyl)-4-[N-(Pyridine-3-yl)-Methoxycarbonyl-Aminomethyl]-Benzamide (MS-275) Polymorph B BAYER SCHERING PHARMA AG (DE) 2010-03-04 US disclosed
US-20050215601-A1 Therapeutic agent for rheumatic disease comprising benzamide derivative as active ingredient SANTEN PHARMACEUTICAL CO., LTD. (JP) 2005-09-29 US 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-20050215601-A1 Therapeutic agent for rheumatic disease comprising benzamide derivative as active ingredient SSB, HRH2, TYR HDAC1 13/4885HDAC3 88/4885HDAC2 17/4885
US-20240398944-A1 COMBINATION OF HDAC INHIBITOR AND ANTI-PD-1 ANTIBODY FOR TREATMENT OF CANCER HDAC1, HDAC4, HDAC9 HDAC1 1/4885HDAC3 9/4885HDAC2 6/4885
US-20100056585-A1 N-(2-Aminophenyl)-4-[N-(Pyridine-3-yl)-Methoxycarbonyl-Aminomethyl]-Benzamide (MS-275) Polymorph B CYP3A5, MRPS35, NNMT HDAC1 482/4885HDAC3 1186/4885HDAC2 767/4885
US-20250064925-A1 METHOD OF TREATING CANCER USING A COMBINATION OF ENTINOSTAT AND AN ANTI-CSF-1R ANTIBODY CSF3R, CSF1R, HDAC1 HDAC1 3/4885HDAC3 12/4885HDAC2 7/4885

“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.