SCHEMBL3900474

SCHEMBL3900474

CCOC(=O)c1ccc(N2CCCCC2)cc1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SIRT2 Q8IXJ6 2/20 0.60
SIRT1 Q96EB6 2/20 0.60
ALDH1A1 P00352 6/20 0.59
RAB9A P51151 4/20 0.59
HPGD P15428 3/20 0.59
NPC1 O15118 3/20 0.59
HTT P42858 2/20 0.59
SMN1; SMN2 Q16637 1/20 0.59
TSHR P16473 2/20 0.59
PKM P14618 1/20 0.59
MAPT P10636 2/20 0.56
GAA P10253 1/20 0.56
TDP1 Q9NUW8 2/20 0.56
HSP90AA1 P07900 1/20 0.56
CACNA1B Q00975 1/20 0.56
APBA1 Q02410 1/20 0.56
NPSR1 Q6W5P4 1/20 0.56
MEN1 O00255 3/20 0.55
KMT2A Q03164 3/20 0.55
CA12 O43570 1/20 0.54

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
SCHEMBL3898465 0.98 HPGD (0.61) SIRT2SIRT1ALDH1A1RAB9AHPGD
SCHEMBL28242074 0.95 HPGD (0.61) SIRT2SIRT1ALDH1A1RAB9AHPGD
SCHEMBL20187714 0.94 HPGD (0.59) SIRT2SIRT1ALDH1A1RAB9AHPGD
SCHEMBL22015905 0.92 HPGD (0.65) ALDH1A1RAB9AHPGDNPC1HTT
SCHEMBL20188098 0.92 HPGD (0.65) ALDH1A1RAB9AHPGDNPC1HTT
SCHEMBL18821718 0.92 RAB9A (0.55) SIRT2SIRT1ALDH1A1RAB9AHPGD
SCHEMBL14871042 0.90 RAB9A (0.56) SIRT2SIRT1ALDH1A1RAB9AHPGD
SCHEMBL18821737 0.90 RAB9A (0.56) SIRT2SIRT1ALDH1A1RAB9AHPGD
SCHEMBL3067260 0.86 ALDH1A1 (0.58) ALDH1A1RAB9AHPGDHTTSMN1; SMN2
SCHEMBL4690718 0.86 MEN1 (0.71) SIRT2SIRT1ALDH1A1RAB9AHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230181746-A1 BENZOYLHYDRAZIDE-DERIVED HDAC DEGRADERS AS THERAPEUTICS FOR TREATING CANCER AND OTHER HUMAN DISEASES UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INC. 2023-06-15 US disclosed
EP-3371196-B1 HETEROCYCLIC COMPOUNDS AS INHIBITORS OF PLATELET AGGREGATION UNIV MONTREAL (CA) 2021-10-27 EP disclosed
EP-3363645-B1 PRETREATMENT OF UV CURED INK UNDER-LAYERS XEROX CORP (US) 2019-10-23 EP disclosed
EP-3375621-A2 TWO COMPONENT INK JETTABLE PRIMER AND INCORPORATION OF ADHESION PROMOTER TO THE INK FOR PRINTING ONTO 3D OBJECTS Xerox Corporation (US) 2018-09-19 EP disclosed
EP-3363645-A1 PRETREATMENT OF UV CURED INK UNDER-LAYERS Xerox Corporation (US) 2018-08-22 EP disclosed
US-10005294-B1 Two component ink jettable primer and incorporation of adhesion promoter to the ink for printing onto 3D objects XEROX CORPORATION (US) 2018-06-26 US disclosed
US-20180141923-A1 SELECTIVE HDAC1,2 INHIBITORS REGENACY PHARMACEUTICALS, LLC 2018-05-24 US disclosed
US-9969185-B1 Pretreatment of UV cured ink under-layers XEROX CORPORATION (US) 2018-05-15 US disclosed
US-9809602-B2 Compounds for treating viral infections INSTITUT PASTEUR KOREA (KR) 2017-11-07 US disclosed
US-20170044181-A1 COMPOUNDS FOR TREATING VIRAL INFECTIONS INSTITUT PASTEUR KOREA (KR) 2017-02-16 US disclosed
US-6342497-B1 2″-deoxy hygromycin derivatives PFIZER INC 2002-01-29 US disclosed
US-6313100-B1 ANTIBACTERIAL, ANTIPROTOZOA AGENTS PFIZER INC 2001-11-06 US disclosed
CN-1299365-A Hygromycin A derivatives PFIZER PROD INC (US) 2001-06-13 CN disclosed
EP-1077984-A1 2\"-DEOXY HYGROMYCIN DERIVATIVES Pfizer Products Inc. (US) 2001-02-28 EP disclosed
EP-1075483-A2 HYGROMYCIN A DERIVATIVES Pfizer Products Inc. (US) 2001-02-14 EP disclosed
EP-0976722-A1 BENZAMIDINE DERIVATIVES Ajinomoto Co., Inc. (JP) 2000-02-02 EP disclosed
CN-1243505-A Benzamidine derivatives AJINOMOTO KK (JP) 2000-02-02 CN disclosed
WO-1999057127-A1 2'-DEOXY HYGROMYCIN DERIVATIVES PFIZER PRODUCTS INC. (US) 1999-11-11 WO disclosed
WO-1999057125-A2 HYGROMYCIN A DERIVATIVES PFIZER PRODUCTS INC. (US) 1999-11-11 WO disclosed
US-4250315-A 2-(SUBSTITUTED AMINO-PHENYL), SULFONIC ACID SUBSTITUTED HOFFMANN-LA ROCHE INC. (US) 1981-02-10 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 (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-20180141923-A1 SELECTIVE HDAC1,2 INHIBITORS HDAC1, HDAC2, HDAC11 SIRT2 35/4885SIRT1 52/4885ALDH1A1 1155/4885
US-20230181746-A1 BENZOYLHYDRAZIDE-DERIVED HDAC DEGRADERS AS THERAPEUTICS FOR TREATING CANCER AND OTHER HUMAN DISEASES HDAC3, HDAC1, HDAC5 SIRT2 77/4885SIRT1 73/4885ALDH1A1 1578/4885
US-20170044181-A1 COMPOUNDS FOR TREATING VIRAL INFECTIONS HAVCR2, MAVS, EIF2AK2 SIRT2 1389/4885SIRT1 1175/4885ALDH1A1 676/4885

“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.