SCHEMBL16433366

SCHEMBL16433366

CC(=O)c1[nH]c2ccccc2c1C(=O)O

nearest known ligand 0.66

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.66
TDP1 Q9NUW8 1/20 0.59
MEN1 O00255 3/20 0.55
KMT2A Q03164 3/20 0.55
ALDH1A1 P00352 4/20 0.53
HPGD P15428 2/20 0.53
POLB P06746 1/20 0.49
FOLH1 Q04609 1/20 0.47
HSD17B10 Q99714 2/20 0.47
MAP2 P11137 2/20 0.47
GAA P10253 1/20 0.47
MAPT P10636 1/20 0.47
GFER P55789 1/20 0.47
APP P05067 1/20 0.46
NR4A2 P43354 1/20 0.46

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
SCHEMBL87871 0.87 KDM4E (0.65) KDM4ETDP1MEN1KMT2AALDH1A1
SCHEMBL2339411 0.86 KDM4E (0.66) KDM4ETDP1MEN1KMT2AALDH1A1
SCHEMBL29955046 0.86 KDM4E (0.66) KDM4ETDP1MEN1KMT2AALDH1A1
SCHEMBL10704376 0.81 ALDH1A1 (0.61) KDM4EMEN1KMT2AALDH1A1HPGD
SCHEMBL3275504 0.81 MEN1 (0.65) KDM4ETDP1MEN1KMT2AALDH1A1
SCHEMBL9654119 0.81 KDM4E (0.57) KDM4ETDP1MEN1KMT2AALDH1A1
SCHEMBL29950909 0.79 KDM4E (1.00) KDM4ETDP1MEN1KMT2AALDH1A1
SCHEMBL30373749 0.78 KDM4E (0.53) KDM4EMEN1KMT2AALDH1A1HPGD
SCHEMBL570154 0.78 NR4A2 (0.67) KDM4ETDP1MEN1KMT2AALDH1A1
SCHEMBL5568381 0.78 KDM4E (0.53) KDM4EMEN1KMT2AALDH1A1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220340893-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2022-10-27 US disclosed
EP-3456718-B1 ISATIN-DERIVED COMPOUNDS, USE OF THE COMPOUNDS FOR THE TREATMENT OF AIDS AND HBV INFECTIONS FUNDACAO OSWALDO CRUZ (BR) 2021-02-17 EP disclosed
US-20190177305-A1 ISATIN-DERIVED COMPOUNDS, USE OF THE COMPOUNDS FOR THE TREATMENT OF AIDS AND METHOD OF TREATMENT USING THESE COMPOUNDS FUNDAÇÃO OSWALDO CRUZ (BR) 2019-06-13 US disclosed
EP-3456718-A1 ISATIN-DERIVED COMPOUNDS, USE OF THE COMPOUNDS FOR THE TREATMENT OF AIDS AND METHOD OF TREATMENT USING THESE COMPOUNDS Fundação Oswaldo Cruz (fiocruz) - Superintendência De Planejamento (BR) 2019-03-20 EP disclosed
WO-2017193180-A1 ISATIN-DERIVED COMPOUNDS, USE OF THE COMPOUNDS FOR THE TREATMENT OF AIDS AND METHOD OF TREATMENT USING THESE COMPOUNDS FUNDAÇÃO OSWALDO CRUZ (FIOCRUZ) - SUPERINTENDÊNCIA DE PLANEJAMENTO (BR) 2017-11-16 WO disclosed
US-8946283-B2 Composition for preventing or treating obesity, dyslipidemia, fatty liver or diabetes containing indole-3-carbinol derivative as active ingredient INDUSTRY-ACADEMIC COOPERATION FOUNDATION, YONSEI UNIVERSITY (KR) 2015-02-03 US disclosed
US-8946283-B2 Composition for preventing or treating obesity, dyslipidemia, fatty liver or diabetes containing indole-3-carbinol derivative as active ingredient INDUSTRY-ACADEMIC COOPERATION FOUNDATION, YONSEI UNIVERSITY (KR) 2015-02-03 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 (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-20190177305-A1 ISATIN-DERIVED COMPOUNDS, USE OF THE COMPOUNDS FOR THE TREATMENT OF AIDS AND METHOD OF TREATMENT USING THESE COMPOUNDS IMPDH1, HASPIN, IMPDH2 KDM4E 4051/4885TDP1 4158/4885MEN1 2425/4885

“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.