SCHEMBL3483078

SCHEMBL3483078

CC(C)OC(=O)C1CCCC1

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.42
LMNA P02545 3/20 0.42
CES2 O00748 1/20 0.40
CES1 P23141 1/20 0.40
TSHR P16473 1/20 0.40
HTT P42858 1/20 0.39
KMT2A Q03164 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
ADRB2 P07550 1/20 0.39
ADRB1 P08588 1/20 0.39
ADRB3 P13945 1/20 0.39
CHRM2 P08172 1/20 0.39
CHRM4 P08173 1/20 0.39
CHRM1 P11229 1/20 0.39
CHRM3 P20309 1/20 0.39
RAB9A P51151 1/20 0.37
ALDH1A1 P00352 1/20 0.37
HPGD P15428 1/20 0.36

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
SCHEMBL1421696 0.98 SMN1; SMN2 (0.44) SMN1; SMN2LMNACES2CES1TSHR
Hydrochloric Acid SCHEMBL27538885 0.98 SMN1; SMN2 (0.41) SMN1; SMN2LMNACES2CES1TSHR
SCHEMBL10260369 0.98 SMN1; SMN2 (0.44) SMN1; SMN2LMNACES2CES1TSHR
SCHEMBL10260332 0.98 SMN1; SMN2 (0.44) SMN1; SMN2LMNACES2CES1TSHR
SCHEMBL28284573 0.96 SMN1; SMN2 (0.43) SMN1; SMN2LMNACES2CES1TSHR
SCHEMBL10260350 0.95 SMN1; SMN2 (0.43) SMN1; SMN2LMNACES2CES1TSHR
Hydrochloric Acid SCHEMBL28526029 0.94 SMN1; SMN2 (0.42) SMN1; SMN2LMNACES2CES1TSHR
SCHEMBL1296764 0.90 TSHR (0.43) SMN1; SMN2LMNATSHRKMT2AALDH1A1
SCHEMBL2657918 0.90
Hydrochloric Acid SCHEMBL27570998 0.88 TSHR (0.42) SMN1; SMN2LMNATSHRKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3713415-A1 PESTICIDE COMPOSITIONS Fundació Centre de Regulació Genòmica (ES) 2020-09-30 EP claimed
WO-2019101890-A1 PESTICIDE COMPOSITIONS FUNDACIÓ CENTRE DE REGULACIÓ GENÒMICA (ES) 2019-05-31 WO claimed
CN-101535276-B 2, 4-diaminopyrimidine fused bicyclic derivatives as ALK and c-MET inhibitors CEPHALON INC 2013-08-28 CN claimed
CN-101535276-A 2, 4-diaminopyrimidine fused bicyclic derivatives as ALK and c-MET inhibitors CEPHALON INC (US) 2009-09-16 CN claimed
CN-101287472-A Antiviral 4'-substituted pre-nucleotide phosphoramidates ROCHE PALO ALTO LLC (CH) 2008-10-15 CN claimed
US-12041848-B2 Heterocyclic compound and organic light emitting element comprising same LG CHEM, LTD. (KR) 2024-07-16 US disclosed
US-11779015-B2 Pesticide compositions FUNDACIÓ CENTRE DE REGULACIÓ GENÓMICA (ES) 2023-10-10 US disclosed
US-11711971-B2 Ink composition and method for manufacturing organic light emitting device LG CHEM, LTD. 2023-07-25 US disclosed
US-20230174544-A1 NOVEL COMPOUND AND ORGANIC LIGHT EMITTING DEVICE COMPRISING THE SAME LG CHEM, LTD. (KR) 2023-06-08 US disclosed
US-11641778-B2 Compound and organic light emitting device comprising same LG CHEM, LTD. (KR) 2023-05-02 US disclosed
US-11641778-B2 Compound and organic light emitting device comprising same LG CHEM, LTD. (KR) 2023-05-02 US disclosed
WO-2023020523-A1 BICYCLIC DERIVATIVES AND USE THEREOF JACOBIO PHARMACEUTICALS CO., LTD. (CN) 2023-02-23 WO disclosed
CN-1805965-A Modulators of chemokine receptor activity MERCK & CO INC (US) 2006-07-19 CN disclosed
CN-1802187-A Benzoxazinyl-amido cyclopentyl-heterocyclic modulators of chemokine receptors MERCK & CO INC (US) 2006-07-12 CN disclosed
EP-1660427-A1 SUBSTITUTED ARYLALKANOIC ACID DERIVATIVE AND USE THEREOF Asahi Kasei Pharma Corporation (JP) 2006-05-31 EP disclosed
US-6867320-B2 Substituted phenylalkanoic acid derivatives and use thereof ASAHI KASEI PHARMA CORPORATION (JP) 2005-03-15 US disclosed
WO-2005016862-A1 SUBSTITUTED ARYLALKANOIC ACID DERIVATIVE AND USE THEREOF ASAHI KASEI PHARMA CORPORATION (JP) 2005-02-24 WO disclosed
EP-1477472-A1 SUBSTITUTED PHENYLALKANOIC ACID DERIVATIVE AND USE THEREOF Asahi Kasei Pharma Corporation (JP) 2004-11-17 EP disclosed
US-20040044258-A1 Substituted phenylalkanoic acid derivatives and use thereof ASAHI KASEI PHARMA CORPORATION (JP) 2004-03-04 US disclosed
CN-1248259-A Fused pyridazine derivatives, process for producing the same and use thereof TAKEDA CHEMICAL INDUSTRIES LTD (JP) 2000-03-22 CN 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 (5 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-11641778-B2 Compound and organic light emitting device comprising same CRY1, CYP1A1, CRY2 SMN1; SMN2 4261/4885LMNA 4053/4885CES2 761/4885
US-12041848-B2 Heterocyclic compound and organic light emitting element comprising same CRY1, CRY2, NR2E3 SMN1; SMN2 2961/4885LMNA 2975/4885CES2 2101/4885
US-20230174544-A1 NOVEL COMPOUND AND ORGANIC LIGHT EMITTING DEVICE COMPRISING THE SAME CRY2, CYBA, AHR SMN1; SMN2 3917/4885LMNA 1053/4885CES2 1632/4885
US-20040044258-A1 Substituted phenylalkanoic acid derivatives and use thereof PTGER1, CYSLTR1, PTGS1 SMN1; SMN2 4713/4885LMNA 820/4885CES2 1879/4885
US-11779015-B2 Pesticide compositions ADH1C, DDT, AKR1C3 SMN1; SMN2 4447/4885LMNA 3581/4885CES2 319/4885

“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.