SCHEMBL2193445

SCHEMBL2193445

O=[N+]([O-])c1[c]cccc1I

nearest known ligand 0.35

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.33
ALDH1A1 P00352 2/20 0.33
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
HTT P42858 1/20 0.32
TSHR P16473 1/20 0.32
TDP1 Q9NUW8 3/20 0.31
P2RY6 Q15077 1/20 0.30
GPR35 Q9HC97 1/20 0.30
PARP1 P09874 1/20 0.30

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
SCHEMBL11399787 0.83 C1R (0.35) LMNAALDH1A1MEN1KMT2ATDP1
SCHEMBL33832 0.77 TDP1 (0.46) ALDH1A1MEN1KMT2ATSHRTDP1
SCHEMBL7136437 0.77 TDP1 (0.46) ALDH1A1MEN1KMT2ATSHRTDP1
SCHEMBL2075135 0.75 MAPT (0.36) LMNAALDH1A1MEN1KMT2AHTT
SCHEMBL3042315 0.75 GPR35 (0.42) LMNAALDH1A1MEN1KMT2ATSHR
SCHEMBL455622 0.75 ALDH1A1 (0.48) LMNAALDH1A1TSHRTDP1
SCHEMBL1179579 0.75 PDE7A (0.35) LMNAALDH1A1MEN1KMT2ATSHR
SCHEMBL6129444 0.75 SMN1; SMN2 (0.38) LMNAALDH1A1MEN1KMT2ATSHR
SCHEMBL7907935 0.75 LMNA (0.33) LMNAALDH1A1MEN1KMT2ATSHR
SCHEMBL1179476 0.75 HPGD (0.38) LMNAALDH1A1KMT2AHTTTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9782428-B2 Method for generation of broadly neutralizing anti-pathogen antibodies NORTHEASTERN UNIVERSITY (US) 2017-10-10 US claimed
US-7501438-B2 Pyridoimidazole derivatives FOREST LABORATORIES HOLDINGS LIMITED (BM) 2009-03-10 US claimed
US-20080009491-A1 1-(3-naphthalen-1-yl-imidazo[1,5-a]pyridin-1-yl)-butan-1-one; chronic pain, an inflammatory disorder, rheumatoid arthritis, multiple sclerosis, osteoporosis and osteoarthritis; cannabinoid receptor ligands FOREST LABORATORIES HOLDINGS LIMITED (BM) 2008-01-10 US claimed
WO-2008005908-A2 PYRIDOIMIDAZOLE DERIVATIVES FOREST LABORATORIES HOLDINGS LIMITED (BM) 2008-01-10 WO claimed
EP-2900645-B1 HERBICIDAL AND FUNGICIDAL 3-PHENYLISOXAZOLIN DERIVATIVES BAYER CROPSCIENCE AG (DE) 2019-08-21 EP disclosed
US-20180237487-A1 LECTIN COMPOSITIONS AND METHODS FOR MODULATING AN IMMUNE RESPONSE TO AN ANTIGEN OPSANITX LLC (US) 2018-08-23 US disclosed
US-9951113-B2 Lectin compositions and methods for modulating an immune response to an antigen OPSANITX LLC (US) 2018-04-24 US disclosed
US-20170088595-A1 LECTIN COMPOSITIONS AND METHODS FOR MODULATING AN IMMUNE RESPONSE TO AN ANTIGEN GENITRIX, LLC 2017-03-30 US disclosed
US-9597394-B2 Lectin compositions and methods for modulating an immune response to an antigen OPSANITX LLC (US) 2017-03-21 US disclosed
US-9585392-B2 3-phenylisoxazolin derivatives with herbicidal action BAYER CROPSCIENCE AG (DE) 2017-03-07 US disclosed
US-20150297715-A1 LECTIN COMPOSITIONS AND METHODS FOR MODULATING AN IMMUNE RESPONSE TO AN ANTIGEN GENITRIX, LLC 2015-10-22 US disclosed
US-20150245615-A1 3-PHENYLISOXAZOLIN DERIVATIVES WITH HERBICIDAL ACTION BAYER CROPSCIENCE AG (DE) 2015-09-03 US disclosed
US-5070013-A IMMUNOCHEMICAL ASSAY FOR HUMAN GRANULOCYTE-MACROPHAGE COLONY STIMULATING FACTOR SCHERING CORPORATION (US) 1991-12-03 US disclosed
EP-0422037-A1 IMMUNOCHEMICAL ASSAY FOR HUMAN GRANULOCYTE-MACROPHAGE COLONY STIMULATING FACTOR Schering Biotech Corporation (US) 1991-04-17 EP disclosed
WO-1990011782-A2 IMMUNOCONJUGATES AND PRODRUGS AND THEIR USE IN ASSOCIATION FOR DRUG DELIVERY CELLTECH LIMITED (GB) 1990-10-18 WO disclosed
EP-0392745-A2 Immunoconjugates and prodrugs and their use in association for drug delivery CELLTECH LIMITED (GB) 1990-10-17 EP disclosed
EP-0347078-A1 Hybrid proteins CELLTECH LIMITED (GB) 1989-12-20 EP disclosed
WO-1989012108-A1 IMMUNOCHEMICAL ASSAY FOR HUMAN GRANULOCYTE-MACROPHAGE COLONY STIMULATING FACTOR SCHERING BIOTECH CORPORATION (US) 1989-12-14 WO disclosed
WO-1989012098-A1 HYBRID PROTEINS CELLTECH LIMITED (GB) 1989-12-14 WO disclosed
EP-0344957-A1 Immunochemical assay for human granulocyte-macrophage colony stimulating factor Schering Biotech Corporation (US) 1989-12-06 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-20080009491-A1 1-(3-naphthalen-1-yl-imidazo[1,5-a]pyridin-1-yl)-butan-1-one; chronic pain, an inflammatory disorder, rheumatoid arthritis, multiple sclerosis, osteoporosis and osteoarthritis; cannabinoid receptor ligands CNR1, CNR2, OPRK1 LMNA 1832/4885ALDH1A1 3016/4885MEN1 1588/4885
US-20150245615-A1 3-PHENYLISOXAZOLIN DERIVATIVES WITH HERBICIDAL ACTION CYP4X1, CBR3, PAOX LMNA 2676/4885ALDH1A1 1019/4885MEN1 4770/4885

“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.