SCHEMBL27365318

SCHEMBL27365318

Cc1ccc(C)c(O[SH](=O)=O)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 2/20 0.46
TSHR P16473 3/20 0.44
SMN1; SMN2 Q16637 3/20 0.42
TDP1 Q9NUW8 3/20 0.42
TTR P02766 1/20 0.42
CYP1A2 P05177 1/20 0.42
CYP2C8 P10632 1/20 0.42
CHRM1 P11229 1/20 0.42
ADRA1A P35348 1/20 0.42
PPARG P37231 1/20 0.42
HTR2B P41595 1/20 0.42
PPARA Q07869 1/20 0.42
SLCO1B3 Q9NPD5 1/20 0.42
CISD1 Q9NZ45 1/20 0.42
SLCO1B1 Q9Y6L6 1/20 0.42
HTT P42858 2/20 0.42
LMNA P02545 1/20 0.42
ACHE P22303 1/20 0.41
GAA P10253 1/20 0.39
CA1 P00915 1/20 0.38

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
SCHEMBL18132344 0.83 ACHE (0.41) TSHRSMN1; SMN2TDP1LMNAACHE
SCHEMBL27593834 0.79 MAPT (0.46) CYP2C9SMN1; SMN2TDP1CYP1A2LMNA
SCHEMBL27501899 0.76 LMNA (0.46) TDP1CHRM1ADRA1AHTR2BLMNA
SCHEMBL97154 0.74 TSHR (0.44) CYP2C9TSHRSMN1; SMN2TDP1TTR
SCHEMBL3278966 0.74 ACHE (0.50) CYP2C9TSHRSMN1; SMN2TDP1TTR
SCHEMBL28233351 0.74 LMNA (0.35) CYP2C9TSHRSMN1; SMN2TDP1HTT
SCHEMBL27986003 0.73 TSHR (0.43) TSHRSMN1; SMN2TDP1CYP1A2LMNA
SCHEMBL92174 0.72 ACHE (0.68) CYP2C9TSHRSMN1; SMN2TDP1HTT
SCHEMBL30167567 0.72 ACHE (0.68) CYP2C9TSHRSMN1; SMN2TDP1HTT
Formaldehyde SCHEMBL27962744 0.71 ACHE (0.60) CYP2C9TSHRSMN1; SMN2TDP1HTT

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 17 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103724599-B A kind of synthetic method of poly butylene succinate HENAN ENERGY CHEMICAL GROUP RESEARCH INSTITUTE CO., LTD. (CN) 2015-09-09 CN claimed
CN-103910858-A Synthesis method of biodegradable copolyester HENAN ENERGY CHEMICAL GROUP RES INST CO LTD 2014-07-09 CN claimed
CN-103724599-A Synthesis method of poly(butylene succinate) HENAN ENERGY CHEMICAL GROUP RES INST CO LTD 2014-04-16 CN claimed
CN-102604160-B Organic montmorillonoid flame retardant with high heat resistance and high smoke suppression as well as preparation method thereof UNIV SHANGHAI ENG SCIENCE 2013-04-10 CN claimed
CN-102516033-A Method for preparing hydroquinone by taking 2,5-ditertiary butyl hydroquinone as raw material GUANGDONG FOOD INDUSTRY INST 2012-06-27 CN claimed
CN-103724599-B A kind of synthetic method of poly butylene succinate HENAN ENERGY CHEMICAL GROUP RESEARCH INSTITUTE CO., LTD. (CN) 2015-09-09 CN disclosed
CN-103910858-A Synthesis method of biodegradable copolyester HENAN ENERGY CHEMICAL GROUP RES INST CO LTD 2014-07-09 CN disclosed
CN-103724599-A Synthesis method of poly(butylene succinate) HENAN ENERGY CHEMICAL GROUP RES INST CO LTD 2014-04-16 CN disclosed
CN-102604160-B Organic montmorillonoid flame retardant with high heat resistance and high smoke suppression as well as preparation method thereof UNIV SHANGHAI ENG SCIENCE 2013-04-10 CN disclosed
CN-102604160-A Organic montmorillonoid flame retardant with high heat resistance and high smoke suppression as well as preparation method thereof UNIV SHANGHAI ENG SCIENCE 2012-07-25 CN disclosed
CN-102516033-A Method for preparing hydroquinone by taking 2,5-ditertiary butyl hydroquinone as raw material GUANGDONG FOOD INDUSTRY INST 2012-06-27 CN disclosed
CN-1591183-B Image recording material and planographic printing plate FUJI PHOTO FILM CO LTD 2010-11-10 CN disclosed
CN-101717090-A Hyperbranched quaternary ammonium salt modified organo montmorillonite and preparation method thereof UNIV SHANGHAI ENG SCIENCE 2010-06-02 CN disclosed
CN-100576072-C Lighographic printing plate precursor FUJI PHOTO FILM CO LTD 2009-12-30 CN disclosed
CN-1661474-A Planographic printing plate precursor FUJI PHOTO FILM CO LTD (JP) 2005-08-31 CN disclosed
CN-1591183-A Image recording material and planographic printing plate FUJI PHOTO FILM CO LTD (JP) 2005-03-09 CN disclosed
CN-1056587-A Sulfonic acid that dissolves in hydrocarbon or sulfaminic acid as charge adjuvants for positive electrostatic liquid developers DXIMAGING (US) 1991-11-27 CN disclosed