Benzene

Benzene

SCHEMBL870097

CCC=O.c1ccccc1

nearest known ligand 0.75

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Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.75
▸ MAPK1 P28482 1/20 0.75
▸ TDP1 Q9NUW8 1/20 0.75
▸ TSHR P16473 3/20 0.37
▸ TRPA1 O75762 1/20 0.37
▸ AOX1 Q06278 1/20 0.31
▸ TRPV1 Q8NER1 1/20 0.31
▸ FFAR1 O14842 1/20 0.31
▸ MAPT P10636 1/20 0.31
▸ CYP19A1 P11511 1/20 0.31
▸ RXRA P19793 1/20 0.31
▸ PPARG P37231 1/20 0.31
▸ OXER1 Q8TDS5 1/20 0.31
▸ PSIP1 O75475 1/20 0.30
▸ TP53 P04637 1/20 0.30
▸ BLM P54132 1/20 0.30
▸ CYP2A6 P11509 1/20 0.30

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
Benzene SCHEMBL27911495 0.96 ALDH1A1 (0.69) ALDH1A1MAPK1TDP1TSHRTRPA1
Benzene SCHEMBL27811301 0.96 ALDH1A1 (0.69) ALDH1A1MAPK1TDP1TSHRTRPA1
Benzene SCHEMBL27985570 0.96 ALDH1A1 (0.69) ALDH1A1MAPK1TDP1TSHRTRPA1
Benzene SCHEMBL27570844 0.96 ALDH1A1 (0.69) ALDH1A1MAPK1TDP1TSHRTRPA1
Benzene SCHEMBL27790417 0.89 ALDH1A1 (0.60) ALDH1A1MAPK1TDP1TSHRTRPA1
Propionaldehyde SCHEMBL28312820 0.87 — —
Propionaldehyde SCHEMBL4992 0.87 — —
Propionaldehyde SCHEMBL1332840 0.87 — —
Propionaldehyde SCHEMBL5310572 0.87 — —
Propionaldehyde SCHEMBL7323052 0.87 — —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119291077-A Quick identification method for head and back muscles and tail muscles of colorful salmon 山东省海洋科学研究院(青岛国家海洋科学研究中心) 2025-01-10 — — CN claimed
CN-115957794-B Supported palladium/carbon catalyst for preparing phenylpropionaldehyde by cinnamaldehyde hydrogenation and preparation method thereof 大连理工大学 2024-04-26 — — CN claimed
CN-213913002-U Waste gas absorbing device for injection molding machine 天津煊宇包装制品有限公司 2021-08-10 — — CN claimed
CN-109438151-B A kind of method that aldehyde and ketone are reduced to alcohol 乐山师范学院 2019-07-09 — — CN claimed
CN-109438151-A A kind of method that aldehyde and ketone are reduced to alcohol 乐山师范学院 2019-03-08 — — CN claimed
CN-108191624-A A kind of UV-blue light absorbent and UV-blue light absorbing material 广东省石油与精细化工研究院 2018-06-22 — — CN claimed
CN-108148003-A The synthetic method of OLED material intermediate benzoyl pyrimidines 棓诺(苏州)新材料有限公司 2018-06-12 — — CN claimed
CN-104447267-B A kind of Separation of Benzene ethyl ketone, method of alpha-phenyl ethyl alcohol from 1-Phenylethanone. and alpha-phenyl ethyl alcohol mixture 佛山汉维科技有限公司 2016-12-07 — — CN claimed
CN-105418397-A Method for separating acetophenone and 1-phenethyl alcohol QUZHOU QUNYING CHEMICAL TECH CO LTD 2016-03-23 — — CN claimed
CN-104447267-A Method for separating acetophenone and alpha-phenethyl alcohol from mixture of acetophenone and alpha-phenethyl alcohol HANDWAY TECHNOLOGY FOSHAN CO LTD 2015-03-25 — — CN claimed
CN-101580496-A 5-substituted phenyl-3-isoxazole carboxylic acid and ester compounds, compositions and preparation method thereof UNIV SHENYANG PHARMACEUTICAL (CN) 2009-11-18 — — CN claimed
CN-101580495-A 5-substituted phenyl-3-isoxazole carboxylic acid and ester compounds, compositions and preparation method thereof UNIV SHENYANG PHARMACEUTICAL (CN) 2009-11-18 — — CN claimed
CN-101570766-A Method for preparing natural hypnone and alpha-phenethanol by catalytic conversion of cinnamylic acid catalyzed by mucor mucedo UNIV GUANGXI (CN) 2009-11-04 — — CN claimed
CN-101085824-A Formaldehyde-free, carbonyl- and ring-hydrogenated ketone-aldehyde resins based on alkyl aryl ketones and formaldehyde which have a low oh functionality and a process for preparing them DEGUSSA (DE) 2007-12-12 — — CN claimed
CN-1317308-C Color-stable superabsorbent polymer composition BASF AG (DE) 2007-05-23 — — CN claimed
CN-1788057-A Ink jet ink composition and method for security making VIDEOJET TECHNOLOGIES INC (US) 2006-06-14 — — CN claimed
CN-1764673-A Color stable superabsorbent polymer composition BASF AG (DE) 2006-04-26 — — CN claimed
CN-1243709-C Process for prepn. of alkyl benzoylacrylates CLARIANT FRANCE SA (FR) 2006-03-01 — — CN claimed
CN-1561162-A Highly crosslinked biocidal polystyrene hydantoin particles UNIV AUBURN (US) 2005-01-05 — — CN claimed
CN-1500074-A Process for prepn. of alkyl benzoylacrylates 克莱里安特法国公司 2004-05-26 — — CN claimed
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