SCHEMBL8815246

SCHEMBL8815246

CC(C)c1cc(F)ccc1N

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.50
▸ HRH4 Q9H3N8 1/20 0.42
▸ KEAP1 Q14145 1/20 0.41
▸ RECQL P46063 1/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.35
▸ PSEN1 P49768 2/20 0.35
▸ PSEN2 P49810 2/20 0.35
▸ APH1B Q8WW43 2/20 0.35
▸ NCSTN Q92542 2/20 0.35
▸ APH1A Q96BI3 2/20 0.35
▸ PSENEN Q9NZ42 2/20 0.35
▸ CYP1A2 P05177 1/20 0.34
▸ CYP2A6 P11509 1/20 0.34
▸ GAA P10253 2/20 0.33
▸ JAK2 O60674 2/20 0.33
▸ POLB P06746 1/20 0.33
▸ GFER P55789 1/20 0.33
▸ THRB P10828 1/20 0.33
▸ ALOX12 P18054 1/20 0.33
▸ HTT P42858 1/20 0.33

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
SCHEMBL28198485 0.84 ALDH1A1 (0.48) ALDH1A1HRH4KEAP1L3MBTL1PSEN1
SCHEMBL19730641 0.84 ALDH1A1 (0.48) ALDH1A1HRH4KEAP1L3MBTL1PSEN1
SCHEMBL2755203 0.84 ALDH1A1 (0.39) ALDH1A1L3MBTL1POLB
SCHEMBL24013615 0.83 ALDH1A1 (0.46) ALDH1A1HRH4KEAP1L3MBTL1PSEN1
SCHEMBL22270392 0.83 ALDH1A1 (0.46) ALDH1A1HRH4KEAP1L3MBTL1PSEN1
SCHEMBL10103697 0.82 ALDH1A1 (0.44) ALDH1A1HRH4KEAP1RECQLL3MBTL1
SCHEMBL2315728 0.79 ALDH1A1 (0.52) ALDH1A1HRH4KEAP1L3MBTL1CYP1A2
SCHEMBL12197672 0.78 CYP1A2 (0.39) ALDH1A1HRH4RECQLPSEN1PSEN2
SCHEMBL2155134 0.76 ALDH1A1 (0.48) ALDH1A1L3MBTL1GAAPOLBGFER
SCHEMBL423296 0.76 PSEN1 (0.49) ALDH1A1HRH4RECQLPSEN1PSEN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-9020741-A — — None — — JP disclosed
US-20250115591-A1 NOVEL SULFONAMIDE CARBOXAMIDE COMPOUNDS INFLAZOME LTD (IE) 2025-04-10 — — US disclosed
US-20250109126-A1 DIHYDRO-OXAZOL DERIVATIVE COMPOUNDS AC IMMUNE SA (CH) 2025-04-03 — — US disclosed
CN-114040911-B As NAV1.8 2, 3-Dihydro-quinazoline Compounds as inhibitors 葛兰素史密斯克莱知识产权发展有限公司 2024-10-22 — — CN disclosed
CN-118541366-A Dihydrooxazole derivative compound AC免疫有限公司 2024-08-23 — — CN disclosed
US-12030879-B2 Sulfonyl acetamides as NLRP3 inhibitors INFLAZOME LIMITED (IE) 2024-07-09 — — US disclosed
US-12012392-B2 Sulfonamide carboxamide compounds INFLAZOME LIMITED (IE) 2024-06-18 — — US disclosed
US-11981667-B2 Sulfonamide carboxamide compounds INFLAZOME LIMITED (IE) 2024-05-14 — — US disclosed
US-20240083896-A1 Nitrogen Containing 2,3-Dihydroquinazolinone Compounds as Nav1.8 Inhibitors GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2024-03-14 — — US disclosed
US-11926600-B2 Sulfonylureas and sulfonylthioureas as NLRP3 inhibitors INFLAZOME LIMITED (IE) 2024-03-12 — — US disclosed
US-7879851-B2 such as (E)-3-[2-(1-{[2-(5-Bromopyrimidin-2-yl)-3-cyclopentyl-1-methyl-1H-indole-6-carbonyl]-amino}-cyclobutyl)-3-methyl-3H-benzoimidazol-5-yl]-acrylic Acid, used for the treatment of hepatitis C virus infections BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2011-02-01 — — US disclosed
US-20110015203-A1 Viral Polymerase Inhibitors BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2011-01-20 — — US disclosed
US-7582770-B2 Viral polymerase inhibitors BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2009-09-01 — — US disclosed
US-7582770-B2 Viral polymerase inhibitors BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2009-09-01 — — US disclosed
US-20090170859-A1 Viral Polymerase Inhibitors BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2009-07-02 — — US disclosed
US-20090170859-A1 Viral Polymerase Inhibitors BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2009-07-02 — — US disclosed
WO-2009066060-A2 4-SUBSTITUTED-6-ISOPROPYL-BENZENE-1,3-DIOL COMPOUNDS AND THEIR USE TOPOTARGET A/S (DK) 2009-05-28 — — WO disclosed
US-20080207666-A1 Substituted pyrano[2,3-B]pyridine derivatives as cannabinoid-1 receptor modulators MERCK SHARP & DOHME CORP. 2008-08-28 — — US disclosed
WO-2008094473-A1 SUBSTITUTED PYRANO[2,3-B]PYRIDINE DERIVATIVES AS CANNABINOID-1 RECEPTOR MODULATORS MERCK & CO., INC. (US) 2008-08-07 — — WO disclosed
JP-H0920741-A PRODUCTION OF HYDROXYCABOXYLIC ANILIDE HOECHST AG 1997-01-21 — — JP 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 (10 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-12030879-B2 Sulfonyl acetamides as NLRP3 inhibitors NLRP3, NOD1, NLRP1 ALDH1A1 1078/4885HRH4 203/4885KEAP1 474/4885
US-20240083896-A1 Nitrogen Containing 2,3-Dihydroquinazolinone Compounds as Nav1.8 Inhibitors SCN8A, SCN1A, SCN2A ALDH1A1 1362/4885HRH4 2705/4885KEAP1 1226/4885
US-20080207666-A1 Substituted pyrano[2,3-B]pyridine derivatives as cannabinoid-1 receptor modulators CNR1, CNR2, FAAH ALDH1A1 3086/4885HRH4 74/4885KEAP1 332/4885
US-11981667-B2 Sulfonamide carboxamide compounds NLRP3, NOD1, PYCARD ALDH1A1 640/4885HRH4 1455/4885KEAP1 361/4885
US-20090170859-A1 Viral Polymerase Inhibitors POLR2A, POLR1E, RPP30 ALDH1A1 1822/4885HRH4 3796/4885KEAP1 2190/4885
US-20250115591-A1 NOVEL SULFONAMIDE CARBOXAMIDE COMPOUNDS NLRP3, NOD1, NLRP1 ALDH1A1 754/4885HRH4 1501/4885KEAP1 426/4885
US-20250109126-A1 DIHYDRO-OXAZOL DERIVATIVE COMPOUNDS NLRP3, NLRP1, NOD1 ALDH1A1 949/4885HRH4 1113/4885KEAP1 40/4885
US-11926600-B2 Sulfonylureas and sulfonylthioureas as NLRP3 inhibitors NLRP3, NOD1, NLRP1 ALDH1A1 1551/4885HRH4 2585/4885KEAP1 379/4885
US-20110015203-A1 Viral Polymerase Inhibitors POLR2A, POLR1E, RPP30 ALDH1A1 1822/4885HRH4 3796/4885KEAP1 2190/4885
US-12012392-B2 Sulfonamide carboxamide compounds NLRP3, PYCARD, NOD1 ALDH1A1 1293/4885HRH4 2597/4885KEAP1 551/4885

“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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