SCHEMBL6964514

SCHEMBL6964514

c1ccc(-c2nsc3ccccc23)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.52
ALDH1A1 P00352 4/20 0.52
MAPT P10636 2/20 0.52
HSD17B10 Q99714 1/20 0.52
EPAS1 Q99814 5/20 0.48
ALPL P05186 1/20 0.45
GAA P10253 1/20 0.45
IDO1 P14902 1/20 0.45
HPGD P15428 1/20 0.45
TTK P33981 1/20 0.45
MAPK10 P53779 1/20 0.45
GRM4 Q14833 2/20 0.44
ADORA2A P29274 3/20 0.39
LMNA P02545 1/20 0.39
HTT P42858 1/20 0.39
ADORA3 P0DMS8 1/20 0.39
ADORA2B P29275 1/20 0.39
ADORA1 P30542 1/20 0.39
NPC1 O15118 1/20 0.39
TP53 P04637 1/20 0.39

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
SCHEMBL30987223 0.86 MAPT (0.60) KDM4EALDH1A1MAPTHSD17B10EPAS1
SCHEMBL28563540 0.86 MAPT (0.60) KDM4EALDH1A1MAPTHSD17B10EPAS1
SCHEMBL24566449 0.86 MAPT (0.47) KDM4EALDH1A1MAPTHSD17B10EPAS1
SCHEMBL28072438 0.84 KDM4E (0.46) KDM4EALDH1A1MAPTHSD17B10EPAS1
SCHEMBL29940995 0.84 EPAS1 (0.54) KDM4EALDH1A1MAPTHSD17B10EPAS1
SCHEMBL11359600 0.84 ALDH1A1 (0.46) KDM4EALDH1A1MAPTHSD17B10EPAS1
SCHEMBL24566758 0.82 KDM4E (0.41) KDM4EALDH1A1MAPTHSD17B10EPAS1
SCHEMBL21956018 0.81 IDO1 (0.54) KDM4EALDH1A1MAPTHSD17B10IDO1
SCHEMBL29737320 0.81 KDM4E (0.37) KDM4EALDH1A1MAPTHSD17B10EPAS1
SCHEMBL11352247 0.80 KDM4E (0.42) KDM4EALDH1A1MAPTHSD17B10EPAS1

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-20200157129-A1 IRIDIUM COMPLEX AND ORGANIC ELECTROLUMINESCENCE DEVICE USING THE SAME LUMINESCENCE TECHNOLOGY CORPORATION (TW) 2020-05-21 US disclosed
US-20200157129-A1 IRIDIUM COMPLEX AND ORGANIC ELECTROLUMINESCENCE DEVICE USING THE SAME LUMINESCENCE TECHNOLOGY CORPORATION (TW) 2020-05-21 US disclosed
US-9868722-B2 Monocyclic pyrimidine/pyridine compounds as inhibitors of P97 complex CLEAVE BIOSCIENCES, INC. (US) 2018-01-16 US disclosed
CN-105669588-B The preparation method of benzisothiazole analog derivative 天津大学 2017-11-07 CN disclosed
US-20160304495-A1 MONOCYCLIC PYRIMIDINE/PYRIDINE COMPOUNDS AS INHIBITORS OF P97 COMPLEX CLEAVE BIOSCIENCES, INC. (US) 2016-10-20 US disclosed
CN-105669588-A Preparation method of benzisothiazole derivative 天津大学 2016-06-15 CN disclosed
EP-0946520-B1 ISOQUINOLINAMINE AND PHTHALAZINAMINE DERIVATIVES WHICH INTERACT WITH CRF RECEPTORS NEUROGEN CORP (US) 2003-04-02 EP disclosed
EP-0039795-B1 PROCESS FOR THE PREPARATION OF 1,2-BENZISOTHIAZOLES BASF Aktiengesellschaft (DE) 1983-10-12 EP disclosed
EP-0039795-A1 Process for the preparation of 1,2-benzisothiazoles BASF Aktiengesellschaft (DE) 1981-11-18 EP disclosed
US-4277477-A TREATING CARDIAC ARRHYTHMIA BASF AKTIENGESELLSCHAFT (DE) 1981-07-07 US disclosed
EP-0000750-A1 1,2-Benzisothiazoles and process for their preparation BASF Aktiengesellschaft (DE) 1979-02-21 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-20200157129-A1 IRIDIUM COMPLEX AND ORGANIC ELECTROLUMINESCENCE DEVICE USING THE SAME OPA1, MT-ND5, IMPA1 KDM4E 3886/4885ALDH1A1 348/4885MAPT 698/4885
US-20160304495-A1 MONOCYCLIC PYRIMIDINE/PYRIDINE COMPOUNDS AS INHIBITORS OF P97 COMPLEX PSMG3, PSMD2, PSME1 KDM4E 2933/4885ALDH1A1 2684/4885MAPT 1413/4885

“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.