SCHEMBL3662312

SCHEMBL3662312

COc1ccc(CC(C)=NO)cc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.62
SMN1; SMN2 Q16637 3/20 0.62
CTBP2 P56545 1/20 0.59
HTT P42858 1/20 0.52
ALDH1A1 P00352 7/20 0.49
MAPT P10636 2/20 0.49
GAA P10253 2/20 0.49
KMT2A Q03164 1/20 0.49
TDP1 Q9NUW8 1/20 0.49
PKM P14618 2/20 0.49
HDAC3 O15379 1/20 0.48
HDAC4 P56524 1/20 0.48
HDAC1 Q13547 1/20 0.48
HDAC7 Q8WUI4 1/20 0.48
HDAC2 Q92769 1/20 0.48
HDAC10 Q969S8 1/20 0.48
HDAC11 Q96DB2 1/20 0.48
HDAC8 Q9BY41 1/20 0.48
HDAC6 Q9UBN7 1/20 0.48
HDAC9 Q9UKV0 1/20 0.48

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
SCHEMBL6069214 0.84 PTGS1 (0.61) KDM4ESMN1; SMN2CTBP2MAPTKMT2A
SCHEMBL6069208 0.84 PTGS1 (0.61) KDM4ESMN1; SMN2CTBP2MAPTKMT2A
SCHEMBL25890179 0.82 KDM4E (0.51) KDM4ESMN1; SMN2CTBP2HTTALDH1A1
SCHEMBL873860 0.80 ACACB (0.43) KDM4ESMN1; SMN2CTBP2ALDH1A1MAPT
SCHEMBL3665017 0.79 HTT (0.59) KDM4ESMN1; SMN2CTBP2HTTALDH1A1
SCHEMBL101734 0.78 ALDH1A1 (0.63) KDM4ESMN1; SMN2CTBP2HTTALDH1A1
SCHEMBL101733 0.78 ALDH1A1 (0.63) KDM4ESMN1; SMN2CTBP2HTTALDH1A1
SCHEMBL3531472 0.78 ALDH1A1 (0.63) KDM4ESMN1; SMN2CTBP2HTTALDH1A1
SCHEMBL13268901 0.77 SMN1; SMN2 (0.59) KDM4ESMN1; SMN2CTBP2HTTALDH1A1
SCHEMBL9564540 0.77 SMN1; SMN2 (1.00) KDM4ESMN1; SMN2CTBP2HTTALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230234917-A1 ASPARAGINE DERIVATIVES AND METHODS OF USING SAME SENDA BIOSCIENCES INC (US) 2023-07-27 US disclosed
CN-104382924-A N6-substituted adenosine derivative and N6-substituted adenine derivative and application thereof INST MATERIA MEDICA CAMS 2015-03-04 CN disclosed
EP-2227475-A1 ISOXAZOLOPYRIDINE DERIVATIVES FOR USE IN THE TREATMENT OF HIF-MEDIATED CONDITIONS Fibrogen, Inc. (US) 2010-09-15 EP disclosed
WO-2009073669-A1 ISOXAZOLOPYRIDINE DERIVATIVES FOR USE IN THE TREATMENT OF HIF-MEDIATED CONDITIONS FIBROGEN, INC. (US) 2009-06-11 WO disclosed
US-4880840-A ANIMAL GROWTH REGULATORS BAYER AKTIENGESELLSCHAFT (DE) 1989-11-14 US disclosed
EP-0253258-A2 Arylethanolhydroxylamines, method for their production and their application as performance promoters BAYER AG (DE) 1988-01-20 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 (1 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-20230234917-A1 ASPARAGINE DERIVATIVES AND METHODS OF USING SAME ASNS, SI, NARS1 KDM4E 4207/4885SMN1; SMN2 1784/4885CTBP2 4724/4885

“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.