SCHEMBL536696

SCHEMBL536696

O=c1oc2ccccc2n1CC#CI

nearest known ligand 0.62

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 3/20 0.62
TSHR P16473 3/20 0.62
HPGD P15428 3/20 0.62
USP2 O75604 2/20 0.62
ALDH1A1 P00352 5/20 0.57
NPSR1 Q6W5P4 2/20 0.57
MIF P14174 1/20 0.55
LMNA P02545 1/20 0.54
IDO1 P14902 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
POLB P06746 1/20 0.48

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
SCHEMBL17039271 0.84 MAPK1 (0.62) MAPK1TSHRHPGDUSP2ALDH1A1
SCHEMBL9364339 0.84 MAPK1 (0.62) MAPK1TSHRHPGDUSP2ALDH1A1
SCHEMBL4151771 0.81 MAPK1 (0.68) MAPK1TSHRHPGDUSP2ALDH1A1
SCHEMBL17036528 0.80 MAPK1 (0.57) MAPK1TSHRHPGDUSP2ALDH1A1
SCHEMBL3027838 0.80 MAPK1 (0.66) MAPK1TSHRHPGDUSP2ALDH1A1
SCHEMBL31236317 0.80 MAPK1 (0.66) MAPK1TSHRHPGDUSP2ALDH1A1
SCHEMBL9715926 0.79 CBX7 (0.47) MAPK1TSHRHPGDUSP2ALDH1A1
SCHEMBL9716064 0.79 CD74 (0.57) ALDH1A1MIFIDO1POLB
SCHEMBL536309 0.79 TDP1 (0.47) HPGDALDH1A1MIFLMNAIDO1
SCHEMBL9716002 0.79 MIF (0.44) MIFIDO1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240215572-A1 ANTIMICROBIAL PARTICLE DISPERSION MITSUBISHI PENCIL COMPANY, LIMITED (JP) 2024-07-04 US claimed
US-20170215421-A1 BIOCIDE AGENTS LANXESS DEUTSCHLAND GMBH (DE) 2017-08-03 US claimed
EP-2779830-B1 STABILIZATION OF COMPOUNDS CONTAINING IODINE HAVING POLYMERS COMPRISING NITROGEN LANXESS DEUTSCHLAND GMBH (DE) 2017-05-17 EP claimed
US-9585384-B2 Stabilization of compounds comprising iodine LANXESS DEUTSCHLAND GMBH (DE) 2017-03-07 US claimed
EP-3125688-A1 BIOCIDE AGENTS LANXESS Deutschland GmbH (DE) 2017-02-08 EP claimed
US-20160360753-A1 BIOCIDIC MICROCAPSULES LANXESS DEUTSCHLAND GMBH (DE) 2016-12-15 US claimed
US-9326502-B2 Stabilization of compounds containing iodine having polymers comprising nitrogen LANXESS DEUTSCHLAND GMBH (DE) 2016-05-03 US claimed
US-9328065-B2 Nitrogen-containing inorganic carrier materials LANXESS DEUTSCHLAND GMBH (DE) 2016-05-03 US claimed
WO-2015150430-A1 BIOCIDE AGENTS LANXESS DEUTSCHLAND GMBH (DE) 2015-10-08 WO claimed
EP-2926659-A1 Biocidal agent LANXESS Deutschland GmbH (DE) 2015-10-07 EP claimed
WO-2011000794-A1 POLYMERS CONTAINING HETEROCYCLIC 3-RING COMPOUNDS AND IODINE-CONTAINING COMPOUNDS LANXESS DEUTSCHLAND GMBH (DE) 2011-01-06 WO claimed
EP-2270087-A1 Heterocyclic 3-ring connections and polymers containing iodine compounds LANXESS Deutschland GmbH (DE) 2011-01-05 EP claimed
WO-2010142790-A1 INORGANIC CARRIER MATERIALS CONTAINING HETEROCYCLIC 3-RING COMPOUNDS LANXESS DEUTSCHLAND GMBH (DE) 2010-12-16 WO claimed
EP-1981629-A1 IPBC-CONTAINING COACERVATES Lanxess Deutschland GmbH (DE) 2008-10-22 EP claimed
WO-2007087994-A1 IPBC-CONTAINING COACERVATES LANXESS DEUTSCHLAND GMBH (DE) 2007-08-09 WO claimed
CN-1180477-A Halopropargyl compounds as marine antifouling agents ROHM & HAAS (US) 1998-05-06 CN claimed
EP-0835604-A1 Halopropargyl compounds as marine antifouling agents ROHM AND HAAS COMPANY (US) 1998-04-15 EP claimed
CN-1066758-A Contain the antimicrobial compositions of iodopropargyl compound and isothiazolone and the method for controlling microbial ROHM & HAAS (US) 1992-12-09 CN claimed
US-5156665-A ANTIMICROBIAL COMPOSITIONS COMPRISING IODOPROPARGYL COMPOUNDS AND ISOTHIAZOLONES AND METHODS OF CONTROLLING MICROBES ROHM AND HAAS COMPANY (US) 1992-10-20 US claimed
EP-0493969-A1 Antimicrobial compositions comprising iodopropargyl compounds and isothiazolones ROHM AND HAAS COMPANY (US) 1992-07-08 EP claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 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-20240215572-A1 ANTIMICROBIAL PARTICLE DISPERSION Q6ZSR9, PAM, ACMSD MAPK1 2082/4885TSHR 1718/4885HPGD 1258/4885

“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.