SCHEMBL2953290

SCHEMBL2953290

COCCOc1ccc(C(=O)CBr)cc1

nearest known ligand 0.66

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 6/20 0.66
MAPT P10636 3/20 0.56
L3MBTL1 Q9Y468 2/20 0.50
RAB9A P51151 1/20 0.50
PTPN1 P18031 3/20 0.48
PKM P14618 1/20 0.47
GAA P10253 1/20 0.47
PLK1 P53350 1/20 0.46
THRA P10827 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
SCHEMBL14369395 0.90 GSK3B (0.62) GSK3BMAPTL3MBTL1GAATHRA
SCHEMBL13299300 0.89 GSK3B (0.60) GSK3BMAPTL3MBTL1PTPN1THRA
SCHEMBL864323 0.84 MAPT (0.58) MAPTL3MBTL1RAB9AGAAPLK1
SCHEMBL5057170 0.84 L3MBTL1 (0.70) GSK3BMAPTL3MBTL1PTPN1PLK1
SCHEMBL5055145 0.84 L3MBTL1 (0.65) GSK3BMAPTL3MBTL1THRA
SCHEMBL16806634 0.84 GSK3B (0.68) GSK3BMAPTRAB9APTPN1
SCHEMBL23929839 0.83 GSK3B (0.57) GSK3BMAPTL3MBTL1RAB9APTPN1
SCHEMBL5744957 0.83 THRA (0.65) GSK3BMAPTL3MBTL1PTPN1PKM
SCHEMBL9786122 0.82 GSK3B (0.59) GSK3BMAPTL3MBTL1PTPN1PKM
SCHEMBL13108708 0.82 MAPT (0.63) MAPTL3MBTL1RAB9APKMGAA

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-20240279231-A1 MAP4K4 INHIBITORS AND METHODS OF SYNTHESIS AND USE THEREOF THE BOARD OF REGENTS OF THE UNIVERSITY OF OKLAHOMA (US) 2024-08-22 US disclosed
US-7759349-B2 Control of parasites in animals by the use of imidazo[1,2-b]pyridazine derivatives SCHERING-PLOUGH ANIMAL HEALTH CORPORATION (US) 2010-07-20 US disclosed
EP-1699799-B1 CONTROL OF PARASITES IN ANIMALS BY THE USE OF IMIDAZO [1,2-B]PYRIDAZINE DERIVATIVES SCHERING PLOUGH LTD (CH) 2007-05-16 EP disclosed
EP-1699799-A1 CONTROL OF PARASITES IN ANIMALS BY THE USE OF IMIDAZO [1,2-B]PYRIDAZINE DERIVATIVES Schering-Plough Ltd. (CH) 2006-09-13 EP disclosed
EP-0842923-B1 PYRROLE DERIVATIVES AND MEDICINAL COMPOSITION NIPPON SHINYAKU CO LTD (JP) 2006-03-01 EP disclosed
US-20050182059-A1 Control of parasites in animals by the use of imidazo[1,2-b]pyridazine derivatives SCHERING-PLOUGH ANIMAL HEALTH CORPORATION 2005-08-18 US disclosed
WO-2005066177-A1 CONTROL OF PARASITES IN ANIMALS BY THE USE OF IMIDAZO[1,2-B]PYRIDAZINE DERIVATIVES SCHERING-PLOUGH LTD. (CH) 2005-07-21 WO disclosed
CN-1349796-A Pyrrole derivatives and medicine composition NIPPON SHINYAKU CO LTD (JP) 2002-05-22 CN disclosed
US-6172102-B1 POLLAKIURIA OR URINARY INCONTINENCE NIPPON SHINYAKU CO., LTD. (JP) 2001-01-09 US disclosed
US-5998459-A INCOTINENCE THERAPY NIPPON SHINYAKU CO., LTD. (JP) 1999-12-07 US disclosed
EP-0842923-A1 PYRROLE DERIVATIVES AND MEDICINAL COMPOSITION NIPPON SHINYAKU COMPANY, LIMITED (JP) 1998-05-20 EP 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-20240279231-A1 MAP4K4 INHIBITORS AND METHODS OF SYNTHESIS AND USE THEREOF MAP4K4, MAP4K2, MAPK4 GSK3B 677/4885MAPT 141/4885L3MBTL1 4474/4885
US-20050182059-A1 Control of parasites in animals by the use of imidazo[1,2-b]pyridazine derivatives PLPBP, PIR, PPIP5K2 GSK3B 4620/4885MAPT 4648/4885L3MBTL1 305/4885

“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.