SCHEMBL44838

SCHEMBL44838

OC(c1ccccc1)C(F)(F)F

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
AOC3 Q16853 1/20 0.47
NR1I2 O75469 1/20 0.46
LMNA P02545 5/20 0.43
CES2 O00748 1/20 0.43
CES1 P23141 1/20 0.43
MAPK1 P28482 1/20 0.42
TSHR P16473 1/20 0.41
KDM4E B2RXH2 2/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
ADRA2A P08913 1/20 0.39
ADRA2C P18825 1/20 0.39
HIF1A Q16665 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
RIPK1 Q13546 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
SCHEMBL3077737 1.00 AOC3 (0.47) AOC3NR1I2LMNACES2CES1
SCHEMBL1669527 1.00 AOC3 (0.47) AOC3NR1I2LMNACES2CES1
SCHEMBL4497165 0.86 KIF11 (0.46) NR1I2
SCHEMBL12628146 0.86 KIF11 (0.46) NR1I2
SCHEMBL14593355 0.86 ESR1 (0.48) AOC3NR1I2CES2CES1KDM4E
Trifluoromethanesulfonic Acid SCHEMBL27525495 0.85 NR1I2 (0.49) AOC3NR1I2LMNACES2CES1
SCHEMBL5865837 0.84 AOC3 (0.47) AOC3LMNACES2CES1MAPK1
SCHEMBL5334248 0.81 AOC3 (0.41) AOC3NR1I2LMNACES2CES1
SCHEMBL11381836 0.81 SRD5A2 (0.50) NR1I2TSHR
SCHEMBL28589866 0.81 ALDH1A1 (0.46) AOC3NR1I2LMNAMAPK1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250361247-A1 HIGH-STABILITY BORON-BASED MAGNESIUM SALT, AND EFFICIENT AND LARGE-SCALE PREPARATION METHOD AND USE THEREOF CHONGQING INST OF NEW ENE STOR MATER & EQUIP (CN) 2025-11-27 US claimed
CN-118994765-A Insulation and pressure-resistant material for cable 安徽朗达电线电缆有限公司 2024-11-22 CN claimed
CN-117895064-B Phosphate polymer quasi-solid electrolyte, in-situ solid immobilization preparation method and application 深圳大学 2024-11-19 CN claimed
CN-118325411-B Antifouling paint composition and preparation method thereof 广州翔铭环保新材料有限公司 2024-08-09 CN claimed
CN-118459766-A Fluorosilicone oil containing phosphate and preparation method thereof 中国科学院上海有机化学研究所 2024-08-09 CN claimed
CN-118325411-A Antifouling paint composition and preparation method thereof 广州翔铭环保新材料有限公司 2024-07-12 CN claimed
CN-117895064-A Phosphate polymer quasi-solid electrolyte, in-situ solid immobilization preparation method and application 深圳大学 2024-04-16 CN claimed
US-11760750-B1 Process for preparing levoketoconazole NURAY CHEMICALS PRIVATE LIMITED (IN) 2023-09-19 US claimed
CN-113999342-B Migratable polymer-based functional modifier and preparation method and application thereof 厦门大学 2022-08-12 CN claimed
US-20220033634-A1 CURABLE FLUORINE-BASED ELASTOMER COMPOSITE AND CURED PRODUCT THEREOF 3M INNOVATIVE PROPERTIES COMPANY 2022-02-03 US claimed
CN-1466560-A Process for producing fluorinated methyl-benzyl alcohol �Ѻ͵繤��ʽ���� 2004-01-07 CN claimed
US-6346194-B1 SEPARATING RACEMIC MIXTURE BY CONTACTING WITH CHIRAL STATIONARY PHASE CONSISTING OF YOHIMBINE OR ANALOG THEREOF COVALENTLY BOUND TO REFRACTORY INORGANIC OXIDE CARRIER VIA SPACER UOP LLC 2002-02-12 US claimed
EP-0332392-B1 Dioxane liquid crystal compounds SHOWA SHELL SEKIYU (JP) 1994-12-07 EP claimed
WO-1993012080-A1 SUBSTITUTED DIPHENYLSULFIDES AS SEROTONIN UPTAKE INHIBITORS THE WELLCOME FOUNDATION LIMITED (GB) 1993-06-24 WO claimed
US-5194179-A LIQUID CRYSTAL COMPOUNDS SHOWA SHELL SEKIYU K.K. (JP) 1993-03-16 US claimed
EP-0332392-A2 Dioxane liquid crystal compounds Showa Shell Sekiyu Kabushiki Kaisha (JP) 1989-09-13 EP claimed
EP-0330491-A2 Novel liquid crystal compounds Showa Shell Sekiyu Kabushiki Kaisha (JP) 1989-08-30 EP claimed
EP-0327349-A2 Liquid crystal compounds Showa Shell Sekiyu Kabushiki Kaisha (JP) 1989-08-09 EP claimed
EP-0113570-B1 5-(AMINO OR SUBSTITUTED AMINO) IMIDAZOLES MERCK & CO. INC. (US) 1987-02-25 EP claimed
EP-0113570-A1 5-(Amino or substituted amino) imidazoles MERCK & CO. INC. (US) 1984-07-18 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-11760750-B1 Process for preparing levoketoconazole KHK, KYAT3, PLK3 AOC3 1721/4885NR1I2 2909/4885LMNA 1990/4885

“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.