SCHEMBL4332449

SCHEMBL4332449

CC(C)(C)[Si](C)(C)OCc1cccc(C=O)c1

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAOA P21397 7/20 0.47
MAOB P27338 7/20 0.47
RAB9A P51151 3/20 0.40
NPC1 O15118 2/20 0.40
TDP1 Q9NUW8 1/20 0.40
ALDH1A1 P00352 2/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
BACE1 P56817 1/20 0.38
BRD4 O60885 1/20 0.35
IDO1 P14902 2/20 0.33
UNG P13051 1/20 0.33
SRC P12931 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
Alcohol SCHEMBL9337072 0.94 MAOA (0.43) MAOAMAOBRAB9ANPC1TDP1
SCHEMBL6525877 0.88 MAOA (0.42) MAOAMAOBRAB9ANPC1TDP1
SCHEMBL31371329 0.86 NPC1 (0.50) MAOAMAOBRAB9ANPC1TDP1
SCHEMBL31371240 0.86 SMN1; SMN2 (0.46) MAOAMAOBRAB9ANPC1TDP1
SCHEMBL30688444 0.85 MAOA (0.39) MAOAMAOBRAB9ANPC1TDP1
SCHEMBL3933674 0.85 MAOA (0.39) MAOAMAOBRAB9ANPC1TDP1
SCHEMBL5871100 0.85 TP53 (0.40) MAOAMAOBTDP1ALDH1A1BACE1
SCHEMBL31371264 0.85 MAOB (0.55) MAOAMAOBRAB9ANPC1TDP1
SCHEMBL5881932 0.84 BACE1 (0.35) BACE1
SCHEMBL8772163 0.84 CCNB2 (0.44) MAOAMAOBALDH1A1BACE1IDO1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108026067-B 6-amino-quinoline-3-carbonitriles as COT modulators 吉利德科学公司 2021-01-12 CN disclosed
EP-3319955-B1 6-AMINO-QUINOLINE-3-CARBONITRILS AS COT MODULATORS GILEAD SCIENCES INC (US) 2020-11-25 EP disclosed
US-10316017-B2 COT modulators and methods of use thereof GILEAD SCIENCES, INC. (US) 2019-06-11 US disclosed
WO-2018114965-A1 CLPX INHIBITORY COMPOUNDS FOR THE TREATMENT OF MULTI RESISTANT STAPHYLOCOCCUS AUREUS VIRULENCE AND FOR THE TREATMENT OF LEUKEMIA Technische Universität München (DE) 2018-06-28 WO disclosed
WO-2018114965-A1 CLPX INHIBITORY COMPOUNDS FOR THE TREATMENT OF MULTI RESISTANT STAPHYLOCOCCUS AUREUS VIRULENCE AND FOR THE TREATMENT OF LEUKEMIA Technische Universität München (DE) 2018-06-28 WO disclosed
US-20170362201-A1 COT MODULATORS AND METHODS OF USE THEREOF GILEAD SCIENCES, INC. 2017-12-21 US disclosed
US-20170362201-A1 COT MODULATORS AND METHODS OF USE THEREOF GILEAD SCIENCES, INC. 2017-12-21 US disclosed
US-9815818-B2 Cot modulators and methods of use thereof GILEAD SCIENCES, INC. (US) 2017-11-14 US disclosed
US-9815818-B2 Cot modulators and methods of use thereof GILEAD SCIENCES, INC. (US) 2017-11-14 US disclosed
WO-2017007694-A1 6-AMINO-QUINOLINE-3-CARBONITRILS AS COT MODULATORS GILEAD SCIENCES, INC. (US) 2017-01-12 WO disclosed
US-5614634-A Leukotriene-B4 derivatives, process for their production and their use as pharmaceutical agents SCHERING AKTIENGESELLSCHAFT (DE) 1997-03-25 US disclosed
US-5440044-A Leukotriene-B4 derivatives, process for their production and their use as pharmaceutical agents SCHERING AKTIENGESELLSCHAFT (DE) 1995-08-08 US disclosed
US-5322847-A Inhibit platelet activating factor, block leukotriene D4 receptors PFIZER INC. (US) 1994-06-21 US disclosed
EP-0477311-A1 NEW LEUCOTRIENE B 4? DERIVATIVES, METHODS OF PREPARING THEM AND THEIR USE AS DRUGS SCHERING AKTIENGESELLSCHAFT (DE) 1992-04-01 EP disclosed
WO-1991014676-A1 NEW LEUCOTRIENE B4 DERIVATIVES, METHODS OF PREPARING THEM AND THEIR USE AS DRUGS SCHERING AKTIENGESELLSCHAFT BERLIN UND BERGKAMEN (DE) 1991-10-03 WO disclosed
US-4525586-A Composition and process THE UPJOHN COMPANY (US) 1985-06-25 US disclosed
US-4420632-A PROSTAGLANDINS; ANTICOAGULANTS THE UPJOHN COMPANY (US) 1983-12-13 US disclosed
US-4349689-A Methano carbacyclin analogs THE UPJOHN COMPANY (US) 1982-09-14 US disclosed
US-4306075-A Composition and process THE UPJOHN COMPANY (US) 1981-12-15 US disclosed
US-4306076-A Inter-phenylene CBA compounds THE UPJOHN COMPANY (US) 1981-12-15 US 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-20170362201-A1 COT MODULATORS AND METHODS OF USE THEREOF BRDT, THRB, HCCS MAOA 582/4885MAOB 381/4885RAB9A 4028/4885
US-10316017-B2 COT modulators and methods of use thereof BRDT, THRB, HCCS MAOA 582/4885MAOB 381/4885RAB9A 4028/4885

“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.