SCHEMBL8517411

SCHEMBL8517411

c1ccc(Oc2ccc3ncsc3c2)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ IKBKB O14920 3/20 0.55
▸ TDP1 Q9NUW8 4/20 0.54
▸ NPC1 O15118 3/20 0.54
▸ RAB9A P51151 3/20 0.54
▸ L3MBTL1 Q9Y468 2/20 0.54
▸ TP53 P04637 1/20 0.54
▸ MAPT P10636 1/20 0.54
▸ HTT P42858 1/20 0.54
▸ SMN1; SMN2 Q16637 1/20 0.54
▸ ALDH1A1 P00352 2/20 0.50
▸ HSD17B10 Q99714 1/20 0.50
▸ KDM4E B2RXH2 2/20 0.47
▸ HKDC1 Q2TB90 1/20 0.47
▸ SCN4A P35499 1/20 0.44
▸ SCN9A Q15858 1/20 0.44
▸ LTA4H P09960 4/20 0.43
▸ DYRK1A Q13627 1/20 0.41
▸ TSHR P16473 1/20 0.41
▸ MEN1 O00255 1/20 0.41
▸ KMT2A Q03164 1/20 0.41

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
SCHEMBL31609687 0.86 ALDH1A1 (0.50) IKBKBTDP1NPC1RAB9AL3MBTL1
SCHEMBL4640548 0.86 ALDH1A1 (0.50) IKBKBTDP1NPC1RAB9AL3MBTL1
SCHEMBL21944747 0.85 TDP1 (0.45) IKBKBTDP1NPC1RAB9AL3MBTL1
SCHEMBL18004134 0.85 NPC1 (0.49) IKBKBTDP1NPC1RAB9AL3MBTL1
SCHEMBL18003523 0.81 NPC1 (0.52) IKBKBTDP1NPC1RAB9AL3MBTL1
SCHEMBL22663 0.79 CYP3A4 (0.59) NPC1RAB9AL3MBTL1MAPTSMN1; SMN2
Toluene SCHEMBL11239856 0.78 ALDH1A1 (0.49) TDP1NPC1RAB9AL3MBTL1MAPT
SCHEMBL24156360 0.77 MEN1 (0.52) IKBKBTDP1NPC1RAB9AL3MBTL1
SCHEMBL6003293 0.77 SLC6A4 (0.47) IKBKBTDP1NPC1RAB9AL3MBTL1
SCHEMBL23133 0.77 NPC1 (0.57) TDP1NPC1RAB9AL3MBTL1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024173715-A1 ANTIFUNGAL COMPOSITIONS AND METHODS OF USE THEREOF ARIZONA BOARD OF REGENTS ON BEHALF OF THE UNIVERSITY OF ARIZONA (US) 2024-08-22 — — WO claimed
EP-4570313-A2 CYANOTRIAZOLE COMPOUNDS Otsuka Pharmaceutical Co., Ltd. (JP) 2025-06-18 — — EP disclosed
EP-4219477-A1 CYANOTRIAZOLE COMPOUNDS Otsuka Pharmaceutical Co., Ltd. (JP) 2023-08-02 — — EP disclosed
US-10626095-B2 Cyanotriazole compounds OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2020-04-21 — — US disclosed
CN-105408325-B cyanotriazole compounds 大塚制药株式会社 2019-10-22 — — CN disclosed
US-20160229816-A1 CYANOTRIAZOLE COMPOUNDS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2016-08-11 — — US disclosed
EP-3022199-A1 CYANOTRIAZOLE COMPOUNDS Otsuka Pharmaceutical Co., Ltd. (JP) 2016-05-25 — — EP disclosed
CN-105408325-A Cyanotriazole compounds OTSUKA PHARMA CO LTD 2016-03-16 — — CN disclosed
WO-2015008872-A1 CYANOTRIAZOLE COMPOUNDS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2015-01-22 — — WO disclosed
EP-0607800-B1 Photographic colour recording material AGFA GEVAERT AG (DE) 1999-04-07 — — EP disclosed
EP-0607801-B1 Photographic colour recording material AGFA GEVAERT AG (DE) 1999-04-07 — — EP disclosed
US-5445928-A Improved reproduction at high density with excellent color separation; using gap sensitizer in coupler-free layer containing silver halide emulsion AGFA-GEVAERT AG (DE) 1995-08-29 — — US disclosed
US-5437969-A Improved definition, color separation at high densities AGFA-GEVAERT AG (DE) 1995-08-01 — — US disclosed
EP-0607800-A1 Photographic colour recording material Agfa-Gevaert AG (DE) 1994-07-27 — — EP disclosed
EP-0607801-A1 Photographic colour recording material Agfa-Gevaert AG (DE) 1994-07-27 — — 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-10626095-B2 Cyanotriazole compounds CS, PC, ACAT1 IKBKB 1018/4885TDP1 2138/4885NPC1 1062/4885
US-20160229816-A1 CYANOTRIAZOLE COMPOUNDS CS, PC, ACAT1 IKBKB 1018/4885TDP1 2138/4885NPC1 1062/4885

“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.

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