SCHEMBL759757

SCHEMBL759757

COC(=O)c1cccc2c1cc(B(O)O)n2C(=O)OC(C)(C)C

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 7/20 0.40
CYP11B2 P19099 1/20 0.40
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
GABRG2 P18507 2/20 0.37
GABRB3 P28472 2/20 0.37
GABRA5 P31644 2/20 0.37
CHRM2 P08172 1/20 0.37
CHRM4 P08173 1/20 0.37
CHRM1 P11229 1/20 0.37
CHRM3 P20309 1/20 0.37
NR4A2 P43354 3/20 0.36
MAPT P10636 1/20 0.36
CA12 O43570 1/20 0.35
CA9 Q16790 1/20 0.35
GABRA1 P14867 1/20 0.35
GABRA2 P47869 1/20 0.35
GABRA6 Q16445 1/20 0.35
HSP90AA1 P07900 1/20 0.35

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
SCHEMBL29134465 0.87 L3MBTL1 (0.41) NR1H2MEN1KMT2ACHRM2CHRM4
SCHEMBL2926879 0.83 NR1H2 (0.40) NR1H2GABRG2GABRB3GABRA5CHRM2
SCHEMBL29954668 0.83 NR1H2 (0.40) NR1H2GABRG2GABRB3GABRA5CHRM2
SCHEMBL2878161 0.83 NR1H2 (0.40) NR1H2GABRG2GABRB3GABRA5CHRM2
SCHEMBL22300959 0.82 GABRG2 (0.32) NR1H2KMT2AGABRG2GABRB3GABRA5
SCHEMBL760776 0.82 NR1H2 (0.38) NR1H2CHRM2CHRM4CHRM1CHRM3
SCHEMBL599783 0.81 NR1H2 (0.40) NR1H2GABRG2GABRB3GABRA5CHRM2
SCHEMBL2873485 0.81 NR1H2 (0.40) NR1H2GABRG2GABRB3GABRA5CHRM2
SCHEMBL10214934 0.81 NR1H2 (0.37) NR1H2CHRM2CHRM4CHRM1CHRM3
SCHEMBL759123 0.81 NR1H2 (0.40) NR1H2MAPTCA12CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220144850-A1 INDOLO HEPTAMYL OXIME ANALOGUE AS PARP INHIBITOR CHIA TAI TIANQING PHARMACEUTICAL GROUP CO., LTD. (CN) 2022-05-12 US disclosed
EP-3919495-A1 INDOLO HEPTAMYL OXIME ANALOGUE AS PARP INHIBITOR Chia Tai Tianqing Pharmaceutical Group Co., Ltd. (CN) 2021-12-08 EP disclosed
WO-2021018298-A1 INDOLO-SEVEN-MEMBERED ACYLOXIME COMPOUNDS AS PARP INHIBITORS 南京明德新药研发有限公司 2021-02-04 WO disclosed
WO-2020156577-A1 INDOLO HEPTAMYL OXIME ANALOGUE AS PARP INHIBITOR 正大天晴药业集团股份有限公司 2020-08-06 WO disclosed
US-20120053345-A1 Indazole Compounds ABBOTT LABORATORIES (US) 2012-03-01 US disclosed
US-20120053345-A1 Indazole Compounds ABBOTT LABORATORIES (US) 2012-03-01 US disclosed
US-20120053345-A1 Indazole Compounds ABBOTT LABORATORIES (US) 2012-03-01 US disclosed
US-8008481-B2 Indazole compounds ABBVIE INC. 2011-08-30 US disclosed
US-8008481-B2 Indazole compounds ABBVIE INC. 2011-08-30 US disclosed
US-8008481-B2 Indazole compounds ABBVIE INC. 2011-08-30 US disclosed
EP-2001480-A2 INDAZOLE COMPOUNDS Abbott Laboratories (US) 2008-12-17 EP disclosed
US-20070282101-A1 Indazole compounds ABBVIE INC. 2007-12-06 US disclosed
US-20070282101-A1 Indazole compounds ABBVIE INC. 2007-12-06 US disclosed
US-20070282101-A1 Indazole compounds ABBVIE INC. 2007-12-06 US disclosed
WO-2007117465-A2 INDAZOLE COMPOUNDS ABBOTT LABORATORIES (US) 2007-10-18 WO disclosed
WO-2007117465-A2 INDAZOLE COMPOUNDS ABBOTT LABORATORIES (US) 2007-10-18 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-20070282101-A1 Indazole compounds CYP3A43, CYP3A7, UGT1A1 NR1H2 408/4885CYP11B2 10/4885MEN1 878/4885
US-20220144850-A1 INDOLO HEPTAMYL OXIME ANALOGUE AS PARP INHIBITOR PARP1, PARP2, PARP3 NR1H2 1953/4885CYP11B2 1388/4885MEN1 3060/4885
US-20120053345-A1 Indazole Compounds CYP3A43, CYP3A7, UGT1A1 NR1H2 408/4885CYP11B2 10/4885MEN1 878/4885

“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.