SCHEMBL2048302

SCHEMBL2048302

FC(F)(F)c1ccccc1[S]

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.43
▸ TDP1 Q9NUW8 2/20 0.43
▸ POLB P06746 1/20 0.43
▸ L3MBTL1 Q9Y468 1/20 0.43
▸ IDO1 P14902 2/20 0.40
▸ CA2 P00918 1/20 0.40
▸ TSHR P16473 1/20 0.39
▸ LMNA P02545 2/20 0.39
▸ GAA P10253 1/20 0.39
▸ HSD11B1 P28845 1/20 0.38
▸ NFKB1 P19838 1/20 0.38
▸ KIF11 P52732 1/20 0.38
▸ HTR2C P28335 2/20 0.36
▸ MEN1 O00255 2/20 0.36
▸ KMT2A Q03164 2/20 0.36
▸ MAPT P10636 2/20 0.36
▸ KDM4E B2RXH2 1/20 0.36
▸ CYP1A2 P05177 1/20 0.35
▸ CYP3A4 P08684 1/20 0.35
▸ CYP2D6 P10635 1/20 0.35

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
Hydrochloric Acid SCHEMBL12474454 0.95 ALDH1A1 (0.45) ALDH1A1TDP1POLBL3MBTL1IDO1
SCHEMBL2096793 0.79 ALDH1A1 (0.31) ALDH1A1TDP1POLBL3MBTL1TSHR
SCHEMBL29441997 0.78 ALDH1A1 (0.52) ALDH1A1TDP1POLBL3MBTL1IDO1
SCHEMBL63469 0.78 ALDH1A1 (0.52) ALDH1A1TDP1POLBL3MBTL1IDO1
Hydrogen Sulfide SCHEMBL28274662 0.76 ALDH1A1 (0.50) ALDH1A1TDP1POLBL3MBTL1IDO1
SCHEMBL6002328 0.75 ELANE (0.32) —
Hydrochloric Acid SCHEMBL12474519 0.74 HSD11B1 (0.38) ALDH1A1TDP1POLBL3MBTL1IDO1
Iodide SCHEMBL29093541 0.73 ALDH1A1 (0.48) ALDH1A1TDP1POLBL3MBTL1IDO1
Bromide SCHEMBL29093546 0.73 ALDH1A1 (0.48) ALDH1A1TDP1POLBL3MBTL1IDO1
SCHEMBL732201 0.72 ALDH1A1 (0.50) ALDH1A1TDP1POLBCA2TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112218860-A Substituted phenylthiouracils, their salts and their use as herbicides 先正达农作物保护股份公司 2021-01-12 — — CN claimed
EP-3049072-A1 SYNTHESIS OF DELTA 12-PGJ3 AND RELATED COMPOUNDS William Marsh Rice University (US) 2016-08-03 — — EP claimed
WO-2015048268-A1 SYNTHESIS OF DELTA 12-PGJ3 AND RELATED COMPOUNDS WILLIAM MARSH RICE UNIVERSITY (US) 2015-04-02 — — WO claimed
US-4659720-A POULTRY ANTIPROTOZOA AGENT MERCK & CO., INC. (US) 1987-04-21 — — US claimed
EP-0113570-B1 5-(AMINO OR SUBSTITUTED AMINO) IMIDAZOLES MERCK & CO. INC. (US) 1987-02-25 — — EP claimed
US-4622330-A Antiprotozoal 3-amino or substituted amino pyrazoles MERCK & CO., INC. (US) 1986-11-11 — — US claimed
EP-0113570-A1 5-(Amino or substituted amino) imidazoles MERCK & CO. INC. (US) 1984-07-18 — — EP claimed
US-4366309-A MACROLACTONES SCHERING CORPORATION (US) 1982-12-28 — — US claimed
EP-3605160-B1 COLOR COMPOSITION FOR SOLID-STATE IMAGING ELEMENT TOPPAN PRINTING CO LTD (JP) 2023-08-02 — — EP disclosed
US-11614574-B2 Coloring composition for solid-state imaging element TOPPAN PRINTING CO., LTD. (JP) 2023-03-28 — — US disclosed
CN-109557707-B Liquid crystal display device having a plurality of pixel electrodes DIC株式会社 2022-10-21 — — CN disclosed
CN-110007561-B Green photosensitive resin composition, color filter and image display device 东友精细化工有限公司 2022-07-19 — — CN disclosed
CN-110300919-B Liquid crystal display device having a plurality of pixel electrodes DIC株式会社 2022-07-01 — — CN disclosed
CN-111517902-B Aerobic oxidation system containing sulfinic acid, sulfonic acid or derivatives thereof and photo-oxidation promoting method thereof 清华大学 2022-06-14 — — CN disclosed
EP-0023559-B1 2-(PERHYDRO-1,4-DIAZINO)-PYRIMIDO(5,4-D)PYRIMIDINES, THEIR PREPARATION AND MEDICAMENTS CONTAINING THEM Dr. Karl Thomae GmbH (DE) 1984-09-19 — — EP disclosed
EP-0113570-A1 5-(Amino or substituted amino) imidazoles MERCK & CO. INC. (US) 1984-07-18 — — EP disclosed
US-4410530-A CARDIO-SELECTIVE B-RECEPTOR BLOCKING AGENTS AND STIMULANTS CIBA-GEIGY CORPORATION (US) 1983-10-18 — — US disclosed
EP-0023559-A1 2-(Perhydro-1,4-diazino)-pyrimido(5,4-d)pyrimidines, their preparation and medicaments containing them Dr. Karl Thomae GmbH (DE) 1981-02-11 — — EP disclosed
US-4195090-A ADRENERGIC BLOCKING AGENTS CIBA-GEIGY CORPORATION (US) 1980-03-25 — — US disclosed
US-4115575-A CARDIOVASCULAR DISORDERS CIBA-GEIGY CORPORATION (US) 1978-09-19 — — US disclosed
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