SCHEMBL8663246

SCHEMBL8663246

CCC(CCCCCCCCCBr)C(=O)O

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 3/20 0.63
MAPK1 P28482 1/20 0.63
GRIK1 P39086 2/20 0.46
GRIK2 Q13002 2/20 0.46
LCK P06239 1/20 0.44
PPARD Q03181 1/20 0.44
ZDHHC20 Q5W0Z9 1/20 0.44
ZDHHC2 Q9UIJ5 1/20 0.44
SLC1A2 P43004 3/20 0.43
SLC1A1 P43005 3/20 0.43
CHRM1 P11229 1/20 0.43
AKR1A1 P14550 1/20 0.43
CHRM3 P20309 1/20 0.43
HTR2A P28223 1/20 0.43
HTR2C P28335 1/20 0.43
ADRA1A P35348 1/20 0.43
HRH1 P35367 1/20 0.43
DRD3 P35462 1/20 0.43
SLC6A3 Q01959 1/20 0.43
HDAC1 Q13547 1/20 0.43

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
SCHEMBL361940 1.00 CA2 (0.63) CA2MAPK1GRIK1GRIK2LCK
SCHEMBL1798885 1.00 CA2 (0.63) CA2MAPK1GRIK1GRIK2LCK
SCHEMBL23071374 1.00 CA2 (0.63) CA2MAPK1GRIK1GRIK2LCK
SCHEMBL284756 0.98 CA2 (0.65) CA2MAPK1GRIK1GRIK2LCK
SCHEMBL1554383 0.91 CA2 (0.68) CA2MAPK1GRIK1GRIK2LCK
SCHEMBL14359878 0.89 CA2 (0.77) CA2MAPK1GRIK1GRIK2LCK
SCHEMBL27901184 0.89 CA2 (0.77) CA2MAPK1GRIK1GRIK2LCK
SCHEMBL14360381 0.89 CA2 (0.77) CA2MAPK1GRIK1GRIK2LCK
SCHEMBL10897254 0.87 CA2 (0.81) CA2MAPK1GRIK1GRIK2SLC1A2
SCHEMBL18641746 0.86 GRIK1 (0.58) CA2MAPK1GRIK1GRIK2LCK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119613646-A Electrochromic material based on organic framework structure and electrochromic device thereof 宁波祢若电子科技有限公司 2025-03-14 CN claimed
US-5795561-A TUMOR SPECIFIC; MEDICAL DIAGNOSIS THE BOARD OF REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 1998-08-18 US disclosed
US-5347030-A Radioiodinated phospholipid ether analogues and methods of using same THE BOARD OF REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 1994-09-13 US disclosed
EP-0359197-B1 ANTIHYPERCHOLESTEROLEMIC 4,5-DIARYL-2-SUBSTITUTED THIOIMIDAZOLES THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) 1992-12-23 EP disclosed
US-5093042-A Site-specific for liver; diagnosis of metastatic cancer THE UNIVERSITY OF MICHIGAN (US) 1992-03-03 US disclosed
US-5087721-A Tumor-specific; for diagnosis and therapy THE UNIVERSITY OF MICHIGAN (US) 1992-02-11 US disclosed
US-4965391-A Tumor specific THE UNIVERSITY OF MICHIGAN (US) 1990-10-23 US disclosed
US-4957729-A CONTRAST THE UNIVERSITY OF MICHIGAN (US) 1990-09-18 US disclosed
US-4933157-A IMAGING AGENTS FOR ADRENAL GLANDS THE UNIVERSITY OF MICHIGAN (US) 1990-06-12 US disclosed
EP-0359197-A1 Antihypercholesterolemic 4,5-diaryl-2-substituted thioimidazoles THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) 1990-03-21 EP disclosed
US-4900744-A Antihypercholesterolemic 4,5-diaryl-2-substituted thioimidazoles E. I. DU PONT DE NEMOURS AND COMPANY (US) 1990-02-13 US disclosed
US-4873075-A SITE-SPECIFIC TO LIVER AND HEPATOCYTE; SCINTIGRAPHY IMAGING THE UNIVERSITY OF MICHIGAN (US) 1989-10-10 US disclosed