SCHEMBL8149013

SCHEMBL8149013

CC(C)(C)OC(=O)Nc1cc(N)cc(C(=O)O)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAP4K4 O95819 1/20 0.41
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
HDAC3 O15379 1/20 0.40
HDAC1 Q13547 1/20 0.40
HDAC2 Q92769 1/20 0.40
HDAC8 Q9BY41 1/20 0.40
HDAC6 Q9UBN7 1/20 0.40
MAPT P10636 1/20 0.40
POLB P06746 1/20 0.40
CYP17A1 P05093 3/20 0.39
CA12 O43570 1/20 0.39
CA1 P00915 1/20 0.39
CA9 Q16790 1/20 0.39
P2RY14 Q15391 1/20 0.39
NAMPT P43490 1/20 0.39
PKM P14618 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
PRMT1 Q99873 1/20 0.37
KAT6A Q92794 1/20 0.37

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 SCHEMBL7387613 0.94 MEN1 (0.42) MAP4K4MEN1KMT2AHDAC3HDAC1
SCHEMBL2890076 0.89 PKM (0.47) MEN1KMT2AHDAC3HDAC1HDAC2
SCHEMBL6232755 0.89 MEN1 (0.49) MEN1KMT2AHDAC3HDAC1HDAC2
SCHEMBL10305747 0.87 MAP4K4 (0.46) MAP4K4HDAC3HDAC1HDAC2HDAC8
SCHEMBL24915019 0.87 KDM4E (0.50) MAP4K4MEN1KMT2AHDAC3HDAC1
SCHEMBL25923116 0.83 TPMT (0.48) MEN1KMT2AHDAC3HDAC1HDAC2
SCHEMBL2178704 0.83 CA12 (0.46) MEN1KMT2AHDAC3HDAC1HDAC2
SCHEMBL1025862 0.82 MEN1 (0.45) MEN1KMT2AHDAC3HDAC1HDAC2
SCHEMBL4726163 0.82 EPHX2 (0.42) MEN1KMT2AHDAC3HDAC1HDAC2
SCHEMBL9396335 0.82 KDM4E (0.55) MEN1KMT2AMAPTPOLBL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10864279-B2 Linker-drug and antibody-drug conjugate (ADC) employing the same INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE (TW) 2020-12-15 US disclosed
US-20180169262-A1 LINKER-DRUG AND ANTIBODY-DRUG CONJUGATE (ADC) EMPLOYING THE SAME INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE (TW) 2018-06-21 US disclosed
EP-3335734-A1 LINKER-DRUG AND ANTIBODY-DRUG CONJUGATE (ADC) EMPLOYING THE SAME Industrial Technology Research Institute (TW) 2018-06-20 EP disclosed
WO-2008119772-A1 AMIDE DERIVATIVES AS INHIBITORS OF ASPARTYL PROTEASES MEDIVIR AB (SE) 2008-10-09 WO disclosed
WO-2008119773-A1 AMIDE DERIVATIVES AS INHIBITORS OF ASPARTYL PROTEASES MEDIVIR AB (SE) 2008-10-09 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 (2 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-20180169262-A1 LINKER-DRUG AND ANTIBODY-DRUG CONJUGATE (ADC) EMPLOYING THE SAME ADCY7, ADCY1, ADCY9 MAP4K4 4112/4885MEN1 2210/4885KMT2A 1373/4885
US-10864279-B2 Linker-drug and antibody-drug conjugate (ADC) employing the same ADCY7, ADCY1, ADCY9 MAP4K4 4112/4885MEN1 2210/4885KMT2A 1373/4885

“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.