SCHEMBL859012

SCHEMBL859012

O=C1COc2cc(Br)cnc2N1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP12 P39900 1/20 0.38
CYP11B1 P15538 2/20 0.37
CYP11B2 P19099 2/20 0.37
PARP1 P09874 1/20 0.36
ALDH1A1 P00352 4/20 0.35
MAPT P10636 3/20 0.35
AURKA O14965 2/20 0.34
DAPK3 O43293 2/20 0.34
PRKD3 O94806 2/20 0.34
MAP4K4 O95819 2/20 0.34
ABL1 P00519 2/20 0.34
NTRK1 P04629 2/20 0.34
RET P07949 2/20 0.34
MET P08581 2/20 0.34
PDGFRB P09619 2/20 0.34
PIM1 P11309 2/20 0.34
FGFR1 P11362 2/20 0.34
PDGFRA P16234 2/20 0.34
FLT1 P17948 2/20 0.34
LTK P29376 2/20 0.34

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
SCHEMBL3082129 0.80 ALDH1A1 (0.38) MMP12CYP11B1CYP11B2PARP1ALDH1A1
SCHEMBL7958200 0.80 MMP12 (0.38) MMP12CYP11B1CYP11B2PARP1ALDH1A1
SCHEMBL18307151 0.80 MMP12 (0.38) MMP12CYP11B1CYP11B2PARP1ALDH1A1
SCHEMBL15979057 0.80 NR3C2 (0.39) MMP12CYP11B1CYP11B2NR3C2
SCHEMBL10283759 0.80 MMP12 (0.49) MMP12CYP11B1CYP11B2PARP1ALDH1A1
SCHEMBL17095009 0.78 PARP1 (0.37) MMP12CYP11B1CYP11B2PARP1ALDH1A1
SCHEMBL13748940 0.76 MMP12 (0.39) MMP12CYP11B1CYP11B2PARP1ALDH1A1
SCHEMBL7326455 0.76 PARP1 (0.39) MMP12CYP11B1CYP11B2PARP1ALDH1A1
SCHEMBL21382790 0.76 GRM5 (0.36) MMP12CYP11B1CYP11B2PARP1ALDH1A1
SCHEMBL14804046 0.76 MMP12 (0.39) MMP12CYP11B1CYP11B2PARP1ALDH1A1

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 77 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115867556-B LPA receptor antagonists and uses thereof 吉利德科学公司 2025-05-06 CN disclosed
US-12139474-B2 LPA receptor antagonists and uses thereof GILEAD SCIENCES, INC. (US) 2024-11-12 US disclosed
CN-118852196-A CYP11B2 inhibitor compound, pharmaceutical composition and application thereof 长春金赛药业有限责任公司 2024-10-29 CN disclosed
US-20240002367-A1 LPA RECEPTOR ANTAGONISTS AND USES THEREOF GILEAD SCIENCES, INC. 2024-01-04 US disclosed
US-11802120-B2 Fused cyclic urea derivatives as CRHR2 antagonist RAQUALIA PHARMA INC. (JP) 2023-10-31 US disclosed
US-11702407-B2 LPA receptor antagonists and uses thereof GILEAD SCIENCES, INC. (US) 2023-07-18 US disclosed
US-11702407-B2 LPA receptor antagonists and uses thereof GILEAD SCIENCES, INC. (US) 2023-07-18 US disclosed
EP-3774739-B1 FUSED CYCLIC UREA DERIVATIVES AS CRHR2 ANTAGONIST RAQUALIA PHARMA INC (JP) 2022-05-11 EP disclosed
US-20210380561-A1 LPA RECEPTOR ANTAGONISTS AND USES THEREOF GILEAD SCIENCES, INC. 2021-12-09 US disclosed
US-20210078975-A1 FUSED CYCLIC UREA DERIVATIVES AS CRHR2 ANTAGONIST RAQUALIA PHARMA INC. (JP) 2021-03-18 US disclosed
EP-0357675-A4 PYRIDOOXAZINONE-PYRIDONE COMPOUNDS, CARDIOTONIC COMPOSITIONS INCLUDING THE SAME, AND THEIR USES 1992-01-15 EP disclosed
WO-1991006300-A1 NAPHTHERIDINONE- AND PYRIDOOXAZINONE-PYRIDONE COMPOUNDS, CARDIOTONIC COMPOSITIONS INCLUDING SAME, AND THEIR USES RORER INTERNATIONAL (HOLDINGS), INC. (US) 1991-05-16 WO disclosed
US-5015638-A Cardiovascular disorders, cardiotonic agents for congestive he art failure RHONE-POULENC RORER PHARMACEUTICALS INC. (US) 1991-05-14 US disclosed
EP-0357675-A1 PYRIDOOXAZINONE-PYRIDONE COMPOUNDS, CARDIOTONIC COMPOSITIONS INCLUDING THE SAME, AND THEIR USES RHONE-POULENC RORER INTERNATIONAL (HOLDINGS) INC. (US) 1990-03-14 EP disclosed
US-4906629-A Pyridazinone and pyrazolone compounds, cardiotonic compositions including same, and their uses RORER PHARMACEUTICAL CORPORATION (US) 1990-03-06 US disclosed
US-4866074-A Naphtheridinone- and pyridooxazinone-pyridone compounds, cardiotonic compositions including same, and their uses RORER PHARMACEUTICAL CORPORATION (US) 1989-09-12 US disclosed
US-4829066-A CONGESTIVE HEART FAILURE RORER PHARMACEUTICAL CORPORATION (US) 1989-05-09 US disclosed
US-4822794-A Pyridooxazinone-pyridone compounds, cardiotonic compositions including the same, and their uses RORER PHARMACEUTICAL CORPORATION (US) 1989-04-18 US disclosed
WO-1988008706-A1 PYRIDOOXAZINONE-PYRIDAZINONE AND PYRAZOLONE COMPOUNDS, CARDIOTONIC COMPOSITIONS INCLUDING THE SAME, AND THEIR USE RORER INTERNATIONAL (OVERSEAS) INC. (US) 1988-11-17 WO disclosed
WO-1988008705-A1 PYRIDOOXAZINONE-PYRIDONE COMPOUNDS, CARDIOTONIC COMPOSITIONS INCLUDING THE SAME, AND THEIR USES RORER INTERNATIONAL (OVERSEAS) INC. (US) 1988-11-17 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 (6 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-11702407-B2 LPA receptor antagonists and uses thereof LPAR1, LPAR2, LPAR4 MMP12 859/4885CYP11B1 2557/4885CYP11B2 2738/4885
US-12139474-B2 LPA receptor antagonists and uses thereof LPAR1, LPAR2, LPAR4 MMP12 831/4885CYP11B1 2563/4885CYP11B2 2752/4885
US-20210078975-A1 FUSED CYCLIC UREA DERIVATIVES AS CRHR2 ANTAGONIST CRHR2, CRHR1, CRH MMP12 4193/4885CYP11B1 713/4885CYP11B2 445/4885
US-20240002367-A1 LPA RECEPTOR ANTAGONISTS AND USES THEREOF LPAR1, LPAR2, LPAR4 MMP12 831/4885CYP11B1 2563/4885CYP11B2 2752/4885
US-11802120-B2 Fused cyclic urea derivatives as CRHR2 antagonist CRHR2, CRHR1, CRH MMP12 4193/4885CYP11B1 713/4885CYP11B2 445/4885
US-20210380561-A1 LPA RECEPTOR ANTAGONISTS AND USES THEREOF LPAR1, LPAR2, LPAR4 MMP12 859/4885CYP11B1 2557/4885CYP11B2 2738/4885

“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.