SCHEMBL304493

SCHEMBL304493

O=C(O)c1cc(O)c2c(I)cc(Cl)cc2n1

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
IGFBP5 P24593 2/20 0.35
ALOX15 P16050 1/20 0.35
TSHR P16473 1/20 0.35
HIF1A Q16665 1/20 0.35
IGFBP3 P17936 4/20 0.34
KMO O15229 1/20 0.33
GPR35 Q9HC97 1/20 0.33
HCAR1 Q9BXC0 1/20 0.33
TPMT P51580 1/20 0.32
PTGES O14684 1/20 0.32
PPM1G O15355 1/20 0.32
ALOX5 P09917 1/20 0.32
PTPN1 P18031 1/20 0.32
KDM5A P29375 1/20 0.32
PPM1A P35813 1/20 0.32
PTPN9 P43378 1/20 0.32
DUSP3 P51452 1/20 0.32
PTPN5 P54829 1/20 0.32
PTPN22 Q9Y2R2 1/20 0.32

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
SCHEMBL29384232 0.84 IGFBP3 (0.41) IGFBP5ALOX15TSHRHIF1AIGFBP3
SCHEMBL158714 0.84 IGFBP3 (0.41) IGFBP5ALOX15TSHRHIF1AIGFBP3
Water SCHEMBL17596689 0.83 IGFBP3 (0.40) IGFBP5ALOX15TSHRHIF1AIGFBP3
Water SCHEMBL30546266 0.83 IGFBP3 (0.40) IGFBP5ALOX15TSHRHIF1AIGFBP3
SCHEMBL13037420 0.81 IGFBP5 (0.35) IGFBP5ALOX15TSHRHIF1AIGFBP3
7-Chlorokynurenic Acid SCHEMBL157187 0.71 IGFBP3 (0.47) IGFBP5HIF1AIGFBP3KMOPTGES
7-Chlorokynurenic Acid SCHEMBL29386783 0.71 IGFBP3 (0.47) IGFBP5HIF1AIGFBP3KMOPTGES
SCHEMBL9463397 0.71 AKR1C4 (0.44) ALOX15TSHRIGFBP3GPR35PTGES
7-Chlorokynurenic Acid SCHEMBL31238955 0.71 IGFBP3 (0.47) IGFBP5HIF1AIGFBP3KMOPTGES
SCHEMBL7524860 0.70 KDM4E (0.44) IGFBP5ALOX15TSHRIGFBP3

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
WO-1995028081-A1 ADDRESSING BAIT AVERSION BY DISRUPTING ASSOCIATIVE LEARNING THE MEAT INDUSTRY RESEARCH INSTITUTE OF NEW ZEALAND INC. (NZ) 1995-10-26 WO claimed
EP-3056200-B1 HUPERZINE FOR USE IN TREATING SEIZURE HARVARD COLLEGE (US) 2023-09-06 EP disclosed
EP-3056200-A2 HUPERZINE FOR USE IN TREATING SEIZURE, PAIN, ORTHOSTATIC HYPOTENSION OR VERTIGO President and Fellows of Harvard College (US) 2016-08-17 EP disclosed
EP-1901733-B1 HUPERZINE FOR USE IN THE TREATMENT OF NEUROPATHIC PAIN HARVARD COLLEGE (US) 2016-04-06 EP disclosed
US-8822492-B2 Use of huperzine for disorders PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2014-09-02 US disclosed
US-8193212-B2 Use of huperzine for neuropathic pain PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2012-06-05 US disclosed
US-20120107392-A1 USE OF HUPERZINE FOR DISORDERS PRESIDENT AND FELLOWS OF HARVARD COLLEGE 2012-05-03 US disclosed
US-8093262-B2 Use of huperzine for disorders PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2012-01-10 US disclosed
US-20110224245-A1 Treatment Of Neurological Disorders Using Huperzine PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2011-09-15 US disclosed
EP-2328584-A2 TREATMENT OF NEUROLOGICAL DISORDERS USING HUPERZINE President and Fellows of Harvard College (US) 2011-06-08 EP disclosed
US-5925634-A Use of ibogaine for treating neuropathic pain WASHINGTON UNIVERSITY (US) 1999-07-20 US disclosed
US-5902815-A REDUCING NEUROLOGICAL SIDE EFFECTS OF N-METHYL-D-ASPARTATE ANTAGONISTS WASHINGTON UNIVERSITY (US) 1999-05-11 US disclosed
US-5877173-A CLOZAPINE, OLANZAPINE AND FLUPERLAPINE, AND SALTS, ISOMERS AND ANALOGS THEREOF, IS ADMINISTERED. WASHINGTON UNIVERSITY (US) 1999-03-02 US disclosed
US-5767130-A Use of kainic acid antagonists to prevent toxic side effects of NMDA antagonists OLNEY JOHN W (US) 1998-06-16 US disclosed
US-5629307-A Use of ibogaine in reducing excitotoxic brain damage OLNEY JOHN W (US) 1997-05-13 US disclosed
US-5629336-A Use of glycine/NMDA receptor ligands for the treatment of drug dependence and withdrawal MERCK, SHARP & DOHME LTD. (GB) 1997-05-13 US disclosed
US-5605911-A NEUROTOXIC SIDE EFFECT INHIBITION WASHINGTON UNIVERSITY (US) 1997-02-25 US disclosed
EP-0514023-B1 Use of glycine/NMDA receptor ligands for the manufacture of a medicament for the treatment of drug dependence and withdrawal MERCK SHARP & DOHME (GB) 1996-03-20 EP disclosed
WO-1995028081-A1 ADDRESSING BAIT AVERSION BY DISRUPTING ASSOCIATIVE LEARNING THE MEAT INDUSTRY RESEARCH INSTITUTE OF NEW ZEALAND INC. (NZ) 1995-10-26 WO disclosed
EP-0514023-A1 Use of glycine/NMDA receptor ligands for the manufacture of a medicament for the treatment of drug dependence and withdrawal MERCK SHARP & DOHME LTD. (GB) 1992-11-19 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-20110224245-A1 Treatment Of Neurological Disorders Using Huperzine GAP43, ACHE, NCS1 IGFBP5 2315/4885ALOX15 706/4885TSHR 4307/4885
US-20120107392-A1 USE OF HUPERZINE FOR DISORDERS HCN1, HCN2, ACHE IGFBP5 1891/4885ALOX15 806/4885TSHR 2311/4885

“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.