SCHEMBL229510

SCHEMBL229510

CCOC(=O)CCCc1nc2cc(N(CCCl)CCCl)ccc2n1C

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 5/20 0.76
HDAC1 Q13547 4/20 0.76
HDAC3 O15379 2/20 0.76
HDAC4 P56524 2/20 0.76
HDAC2 Q92769 2/20 0.76
HDAC8 Q9BY41 2/20 0.76
HDAC5 Q9UQL6 2/20 0.76
PTGS1 P23219 1/20 0.76
HDAC10 Q969S8 1/20 0.76
TSHR P16473 2/20 0.41
NPSR1 Q6W5P4 1/20 0.41
RXFP1 Q9HBX9 1/20 0.41
ALDH1A1 P00352 5/20 0.41
MAPT P10636 2/20 0.41
PKM P14618 1/20 0.40
MEN1 O00255 3/20 0.39
KMT2A Q03164 3/20 0.39
RECQL P46063 1/20 0.39
NQO2 P16083 1/20 0.39
GAA P10253 1/20 0.39

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
Hydrochloric Acid SCHEMBL2781680 0.99 HDAC6 (0.74) HDAC6HDAC1HDAC3HDAC4HDAC2
SCHEMBL12973509 0.96 HDAC6 (0.71) HDAC6HDAC1HDAC3HDAC4HDAC2
SCHEMBL16866953 0.96 HDAC6 (0.73) HDAC6HDAC1HDAC3HDAC4HDAC2
SCHEMBL16866946 0.94 HDAC6 (0.69) HDAC6HDAC1HDAC3HDAC4HDAC2
SCHEMBL14823504 0.92 HDAC6 (0.73) HDAC6HDAC1HDAC3HDAC4HDAC2
SCHEMBL16754938 0.92 HDAC6 (0.64) HDAC6HDAC1HDAC3HDAC4HDAC2
SCHEMBL15690680 0.91 HDAC6 (0.72) HDAC6HDAC1HDAC3HDAC4HDAC2
SCHEMBL31688425 0.91 HDAC6 (0.62) HDAC6HDAC1HDAC3HDAC4HDAC2
SCHEMBL365881 0.91 HDAC6 (0.62) HDAC6HDAC1HDAC3HDAC4HDAC2
SCHEMBL9966133 0.90 HDAC6 (0.79) HDAC6HDAC1HDAC3HDAC4HDAC2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11844784-B2 Stable pharmaceutical compositions of bendamustine SLAYBACK PHARMA LLC (US) 2023-12-19 US disclosed
US-20230364017-A1 BENDAMUSTINE SOLID DISPERSIONS AND CONTINUOUS INFUSION VOUDOURIS VASILIOS (US) 2023-11-16 US disclosed
WO-2023213445-A1 METHOD FOR PREPARING 4-[5-[BIS(2-CHLOROETHYL)AMINO]-1-METHYL-1H-BENZO[D]IMIDAZOL-2-YL]BUTYRIC ACID ALKYL ESTERS AND FORMYLATED DERIVATIVES Heraeus Deutschland GmbH & Co. KG (DE) 2023-11-09 WO disclosed
US-20230310384-A1 STABLE PHARMACEUTICAL COMPOSITIONS OF BENDAMUSTINE SLAYBACK PHARMA LLC (US) 2023-10-05 US disclosed
US-20230310384-A1 STABLE PHARMACEUTICAL COMPOSITIONS OF BENDAMUSTINE SLAYBACK PHARMA LLC (US) 2023-10-05 US disclosed
US-20230310381-A1 BENDAMUSTINE PHARMACEUTICAL COMPOSITIONS VOUDOURIS VASILIOS (US) 2023-10-05 US disclosed
EP-3043648-B1 BENDAMUSTINE PHARMACEUTICAL COMPOSITIONS VOUDOURIS VASILIOS (US) 2023-09-20 EP disclosed
US-11707450-B1 Stable pharmaceutical compositions of bendamustine SLAYBACK PHARMA LLC (US) 2023-07-25 US disclosed
US-11707450-B1 Stable pharmaceutical compositions of bendamustine SLAYBACK PHARMA LLC (US) 2023-07-25 US disclosed
US-11701344-B2 Bendamustine pharmaceutical compositions VOUDOURIS VASILIOS (US) 2023-07-18 US disclosed
US-20130123316-A1 Bendamustine Pharmaceutical Compositions CEPHALON LLC 2013-05-16 US disclosed
US-20130123316-A1 Bendamustine Pharmaceutical Compositions CEPHALON LLC 2013-05-16 US disclosed
US-8436190-B2 Bendamustine pharmaceutical compositions CEPHALON, INC. (US) 2013-05-07 US disclosed
WO-2013046223-A1 AN IMPROVED PROCESS FOR THE PREPARATION OF BENDAMUSTINE HYDROCHLORIDE FRESENIUS KABI ONCOLOGY LTD. (IN) 2013-04-04 WO disclosed
EP-2574334-A1 Bendamustine pharmaceutical compositions for lyophilisation CEPHALON, INC. (US) 2013-04-03 EP disclosed
US-20120165543-A1 PROCESS FOR THE PRODUCTION OF BENDAMUSTINE ALKYL ESTER, BENDAMUSTINE, AND DERIVATIVES THEREOF HERAEUS PRECIOUS METALS GMBH & CO. KG (DE) 2012-06-28 US disclosed
EP-2468716-A1 Process for producing bendamustine alkyl esters, bendamustine and derivatives of same Heraeus Precious Metals GmbH & Co. KG (DE) 2012-06-27 EP disclosed
US-20120003305-A1 Oral Dosage Forms Of Bendamustine ASTELLAS DEUTSCHLAND GMBH (DE) 2012-01-05 US disclosed
US-20120003309-A1 Solid Dosage Forms Of Bendamustine ASTELLAS DEUTSCHLAND GMBH (DE) 2012-01-05 US disclosed
WO-2010144675-A1 POLYMORPHS OF BENDAMUSTINE HCL AND PROCESSES FOR PREPARATION THEREOF PLUS CHEMICALS SA (CH) 2010-12-16 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 (10 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-20120003305-A1 Oral Dosage Forms Of Bendamustine TAS2R42, TAS2R40, TAS2R45 HDAC6 1882/4885HDAC1 2640/4885HDAC3 2999/4885
US-20120165543-A1 PROCESS FOR THE PRODUCTION OF BENDAMUSTINE ALKYL ESTER, BENDAMUSTINE, AND DERIVATIVES THEREOF OTC, OAT, BCKDK HDAC6 1763/4885HDAC1 2804/4885HDAC3 2766/4885
US-20230310384-A1 STABLE PHARMACEUTICAL COMPOSITIONS OF BENDAMUSTINE SORD, NONO, SBDS HDAC6 1384/4885HDAC1 3398/4885HDAC3 3707/4885
US-11707450-B1 Stable pharmaceutical compositions of bendamustine SORD, NONO, SBDS HDAC6 1270/4885HDAC1 3593/4885HDAC3 3810/4885
US-11844784-B2 Stable pharmaceutical compositions of bendamustine SORD, NONO, SBDS HDAC6 1384/4885HDAC1 3398/4885HDAC3 3707/4885
US-20230310381-A1 BENDAMUSTINE PHARMACEUTICAL COMPOSITIONS FLT3, BLK, FOLR2 HDAC6 1308/4885HDAC1 3917/4885HDAC3 4356/4885
US-11701344-B2 Bendamustine pharmaceutical compositions FLT3, BLK, FOLR2 HDAC6 1308/4885HDAC1 3917/4885HDAC3 4356/4885
US-20130123316-A1 Bendamustine Pharmaceutical Compositions FOLR1, FPGS, FLT3 HDAC6 487/4885HDAC1 3095/4885HDAC3 3718/4885
US-20120003309-A1 Solid Dosage Forms Of Bendamustine SORD, SI, SELL HDAC6 122/4885HDAC1 182/4885HDAC3 428/4885
US-20230364017-A1 BENDAMUSTINE SOLID DISPERSIONS AND CONTINUOUS INFUSION WEE1, SLC29A2, SLC29A1 HDAC6 1618/4885HDAC1 2772/4885HDAC3 4295/4885

“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.