SCHEMBL425873

SCHEMBL425873

[CH2]CNC(=O)Cc1ccccc1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC8 Q9BY41 2/20 0.61
HDAC6 Q9UBN7 2/20 0.61
MEN1 O00255 1/20 0.61
KMT2A Q03164 1/20 0.61
GAA P10253 2/20 0.59
HPGD P15428 2/20 0.59
ALDH1A1 P00352 5/20 0.58
ATM Q13315 1/20 0.58
LMNA P02545 1/20 0.58
EPHX2 P34913 1/20 0.57
RAB9A P51151 1/20 0.56
CNR1 P21554 1/20 0.56
MAPT P10636 1/20 0.56
L3MBTL1 Q9Y468 1/20 0.56
TRPV1 Q8NER1 1/20 0.56
KCNH2 Q12809 1/20 0.54
ERCC1 P07992 1/20 0.53
ERCC4 Q92889 1/20 0.53
POLB P06746 1/20 0.53
CES2 O00748 1/20 0.52

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
SCHEMBL5181766 0.84 HPGD (0.66) HDAC8HDAC6MEN1KMT2AGAA
SCHEMBL60235 0.83 MEN1 (0.65) HDAC8HDAC6MEN1KMT2AGAA
SCHEMBL11034177 0.83 HDAC8 (0.65) HDAC8HDAC6MEN1KMT2AGAA
SCHEMBL23723912 0.82 ALDH1A1 (0.43) HDAC8HDAC6MEN1KMT2AGAA
SCHEMBL9645345 0.82 CA2 (0.52) HPGDALDH1A1LMNARAB9ATRPV1
Phenaceturic Acid SCHEMBL28124919 0.81 ATM (0.56) HDAC8HDAC6MEN1KMT2AGAA
SCHEMBL4683120 0.81 HPGD (0.72) HDAC8HDAC6MEN1KMT2AGAA
SCHEMBL392625 0.81 ALDH1A1 (0.82) HDAC8HDAC6MEN1KMT2AGAA
SCHEMBL1454495 0.81 MEN1 (0.63) HDAC8HDAC6MEN1KMT2AGAA
SCHEMBL5196581 0.80 HDAC2 (0.63) HDAC8HDAC6MEN1KMT2AHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1347406-A Carbamic acid derivs. and their use as metabotropic glutamate receptor ligands HOFFMANN LA ROCHE (CH) 2002-05-01 CN claimed
US-20120070409-A1 TETRACYCLIC FUSED HETEROCYCLIC COMPOUND AND USE THEREOF AS HCV POLYMERASE INHIBITOR JAPAN TOBACCO INC. (JP) 2012-03-22 US disclosed
US-20120020920-A1 5-5-MEMBERED FUSED HETEROCYCLIC COMPOUND AND USE THEREOF AS HCV POLYMERASE INHIBITOR JAPAN TOBACCO INC. (JP) 2012-01-26 US disclosed
US-7977331-B1 Tetracyclic fused heterocyclic compound and use thereof as HCV polymerase inhibitor JAPAN TOBACCO INC. (JP) 2011-07-12 US disclosed
EP-2206715-A1 Fused heterotetracyclic compounds and use thereof as hcv polymerase inhibitor Japan Tobacco, Inc. (JP) 2010-07-14 EP disclosed
US-7659263-B2 Thienopyrrole compound and use thereof as HCV polymerase inhibitor JAPAN TOBACCO INC. (JP) 2010-02-09 US disclosed
EP-1719773-B1 FUSED HETEROTETRACYCLIC COMPOUNDS AND USE TEHREOF AS HCV POLYMERASE INHIBITOR JAPAN TOBACCO INC (JP) 2009-04-15 EP disclosed
US-20090036444-A1 5-5-Membered fused heterocyclic compound and use thereof as HCV polymerase inhibitor JAPAN TOBACCO INC. (JP) 2009-02-05 US disclosed
EP-0945448-B1 5-ALKOXY-2(3H)-OXAZOLONE COMPOUNDS AND PROCESS FOR THE PREPARATION THEREOF UBE INDUSTRIES (JP) 2008-11-26 EP disclosed
US-7427616-B2 Condensed pyridines and pyrimidines with tie2 (TEK) activity ASTRAZENECA AB (SE) 2008-09-23 US disclosed
EP-1000937-A1 PROCESS FOR PRODUCING 4-ALKOXYCARBONYL-2-OXAZOLIDINONE COMPOUNDS UBE INDUSTRIES LIMITED (JP) 2000-05-17 EP disclosed
US-6020496-A 5-alkoxy-2(3H)-oxazolone compounds and process for preparing the same UBE INDUSTRIES, LTD. (JP) 2000-02-01 US disclosed
EP-0945448-A1 5-ALKOXY-2(3H)-OXAZOLONE COMPOUNDS AND PROCESS FOR THE PREPARATION THEREOF UBE INDUSTRIES, LTD. (JP) 1999-09-29 EP disclosed
EP-0640102-A1 ACTIVATION-STATE-SPECIFIC PHOSPHOPROTEIN IMMUNODETECTION DANA-FARBER CANCER INSTITUTE, INC. (US) 1995-03-01 EP disclosed
WO-1993021230-A1 ACTIVATION-STATE-SPECIFIC PHOSPHOPROTEIN IMMUNODETECTION DANA-FARBER CANCER INSTITUTE, INC. (US) 1993-10-28 WO disclosed
CN-1030917-A IMMUNOSUPPRESSANT PEPTIDES MERRELL DOW PHARMA (US) 1989-02-08 CN disclosed
EP-0154190-A1 Pyridones MERCK PATENT GmbH (DE) 1985-09-11 EP disclosed
US-4410530-A CARDIO-SELECTIVE B-RECEPTOR BLOCKING AGENTS AND STIMULANTS CIBA-GEIGY CORPORATION (US) 1983-10-18 US disclosed
US-4195090-A ADRENERGIC BLOCKING AGENTS CIBA-GEIGY CORPORATION (US) 1980-03-25 US disclosed
US-4115575-A CARDIOVASCULAR DISORDERS CIBA-GEIGY CORPORATION (US) 1978-09-19 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-20090036444-A1 5-5-Membered fused heterocyclic compound and use thereof as HCV polymerase inhibitor GTF3C5, ZC3HAV1, POLI HDAC8 432/4885HDAC6 64/4885MEN1 4807/4885
US-20120020920-A1 5-5-MEMBERED FUSED HETEROCYCLIC COMPOUND AND USE THEREOF AS HCV POLYMERASE INHIBITOR GTF3C5, ZC3HAV1, POLI HDAC8 432/4885HDAC6 64/4885MEN1 4807/4885
US-20120070409-A1 TETRACYCLIC FUSED HETEROCYCLIC COMPOUND AND USE THEREOF AS HCV POLYMERASE INHIBITOR POLI, TERT, ZC3HAV1 HDAC8 380/4885HDAC6 82/4885MEN1 4753/4885

“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.