SCHEMBL6792137

SCHEMBL6792137

CC(=O)Nc1cccc(-c2ccc(C=O)cc2)c1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP17A1 P05093 2/20 0.60
CYP11B1 P15538 1/20 0.60
CYP11B2 P19099 1/20 0.60
HSD17B1 P14061 1/20 0.56
HSD17B2 P37059 1/20 0.56
MEN1 O00255 1/20 0.55
KMT2A Q03164 1/20 0.55
NQO2 P16083 2/20 0.54
PIP4K2A P48426 1/20 0.52
PIP4K2B P78356 1/20 0.52
ALDH1A1 P00352 2/20 0.51
MGLL Q99685 1/20 0.51
CYP1A2 P05177 1/20 0.51
HSD17B10 Q99714 1/20 0.51
NPC1 O15118 3/20 0.51
RAB9A P51151 3/20 0.51
SMN1; SMN2 Q16637 3/20 0.51
MAPT P10636 2/20 0.51
LMNA P02545 1/20 0.51
TP53 P04637 1/20 0.51

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
SCHEMBL15329674 0.89 NQO2 (0.55) CYP17A1CYP11B1CYP11B2HSD17B1HSD17B2
SCHEMBL6185300 0.86 MGLL (0.57) CYP17A1CYP11B1CYP11B2MGLL
SCHEMBL8577619 0.85 SMN1; SMN2 (0.70) CYP17A1CYP11B1CYP11B2HSD17B1HSD17B2
SCHEMBL15331203 0.84 SMN1; SMN2 (0.59) CYP17A1CYP11B1CYP11B2HSD17B1HSD17B2
SCHEMBL3786463 0.83 NQO2 (0.73) CYP17A1CYP11B1CYP11B2HSD17B1HSD17B2
SCHEMBL6791371 0.83 SMN1; SMN2 (0.73) MEN1KMT2AALDH1A1HSD17B10NPC1
SCHEMBL12999591 0.82 NPC1 (0.69) CYP17A1CYP11B1CYP11B2HSD17B1HSD17B2
SCHEMBL527866 0.82 ALDH1A1 (0.59) MEN1KMT2ANQO2ALDH1A1CYP1A2
SCHEMBL14384612 0.81 CNR1 (0.71) CYP17A1CYP11B1CYP11B2HSD17B1HSD17B2
SCHEMBL4654909 0.81 ALDH1A1 (0.67) CYP17A1CYP11B1CYP11B2HSD17B1HSD17B2

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 11 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-3540059-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES Nuevolution A/S (DK) 2019-09-18 EP disclosed
EP-2558577-B1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION AS (DK) 2018-12-12 EP disclosed
US-9637491-B2 Pyrazolo[4,3-D]pyrimidines as kinase inhibitors ORIGENIS GMBH (DE) 2017-05-02 US disclosed
US-20150266882-A1 PYRAZOLO[4,3-D]PYRIMIDINES AS KINASE INHIBITORS ORIGENIS GMBH (DE) 2015-09-24 US disclosed
US-20040147573-A1 Metalloproteinase inhibitors ASTRAZENECA AB (SE) 2004-07-29 US disclosed
US-20040110809-A1 Metalloproteinase inhibitors ASTRAZENECA AB (SE) 2004-06-10 US disclosed
EP-1370536-A1 METALLOPROTEINASE INHIBITORS AstraZeneca AB (SE) 2003-12-17 EP disclosed
EP-1370538-A1 METALLOPROTEINASE INHIBITORS AstraZeneca AB (SE) 2003-12-17 EP disclosed
WO-2002074752-A1 METALLOPROTEINASE INHIBITORS ASTRAZENECA AB (SE) 2002-09-26 WO disclosed
WO-2002074750-A1 METALLOPROTEINASE INHIBITORS ASTRAZENECA AB (SE) 2002-09-26 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 (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-20040110809-A1 Metalloproteinase inhibitors MMP9, MMP2, MMP3 CYP17A1 190/4885CYP11B1 353/4885CYP11B2 472/4885
US-20150266882-A1 PYRAZOLO[4,3-D]PYRIMIDINES AS KINASE INHIBITORS LRRK2, MYLK2, MYLK CYP17A1 3060/4885CYP11B1 1981/4885CYP11B2 1788/4885
US-20040147573-A1 Metalloproteinase inhibitors MMP12, MMP7, MMP10 CYP17A1 110/4885CYP11B1 139/4885CYP11B2 140/4885

“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.