Benzene

Benzene

SCHEMBL2869929

COC(C)=O.c1ccccc1

nearest known ligand 0.77

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.77
TSHR P16473 4/20 0.46
FFAR3 O14843 1/20 0.43
LCK P06239 1/20 0.43
FYN P06241 1/20 0.43
GAA P10253 2/20 0.40
KCNN4 O15554 1/20 0.40
KMT2A Q03164 1/20 0.40
MGAM O43451 1/20 0.40
SI P14410 1/20 0.40
MGAM2 Q2M2H8 1/20 0.40
HSP90AA1 P07900 1/20 0.39
MAPT P10636 1/20 0.39
NAPRT Q6XQN6 2/20 0.39
HSD17B10 Q99714 2/20 0.39
CA12 O43570 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
CA7 P43166 1/20 0.38
CA9 Q16790 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
Benzene SCHEMBL27466044 0.96 ALDH1A1 (0.71) ALDH1A1TSHRFFAR3LCKFYN
Benzene SCHEMBL28289405 0.96 ALDH1A1 (0.71) ALDH1A1TSHRFFAR3LCKFYN
Benzene SCHEMBL27327290 0.96 ALDH1A1 (0.71) ALDH1A1TSHRFFAR3LCKFYN
Benzene SCHEMBL27971287 0.96 ALDH1A1 (0.71) ALDH1A1TSHRFFAR3LCKFYN
Benzene SCHEMBL28059910 0.96 ALDH1A1 (0.71) ALDH1A1TSHRFFAR3LCKFYN
Benzene SCHEMBL27725651 0.93 ALDH1A1 (0.67) ALDH1A1TSHRFFAR3LCKFYN
Acetic Acid Methyl Ester SCHEMBL28803667 0.88 ALDH1A1 (0.83) ALDH1A1TSHRFFAR3LCKFYN
Acetic Acid Methyl Ester SCHEMBL28664913 0.88 ALDH1A1 (0.83) ALDH1A1TSHRFFAR3LCKFYN
Acetic Acid Methyl Ester SCHEMBL28855988 0.88 ALDH1A1 (0.83) ALDH1A1TSHRFFAR3LCKFYN
Acetic Acid Methyl Ester SCHEMBL28418558 0.88 ALDH1A1 (0.83) ALDH1A1TSHRFFAR3LCKFYN

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250185660-A1 METHODS AND COMPOSITIONS FOR DISRUPTING HERBIVOROUS PESTS AND REDUCING CROP DAMAGE USING PREDATORY INSECT SEMIOCHEMICALS THE PENN STATE RESEARCH FOUNDATION 2025-06-12 US claimed
WO-2024044693-A2 METHODS AND COMPOSITIONS FOR DISRUPTING HERBIVOROUS PESTS AND REDUCING CROP DAMAGE USING PREDATORY INSECT SEMIOCHEMICALS THE PENN STATE RESEARCH FOUNDATION (US) 2024-02-29 WO claimed
CN-106634472-A Resin baking varnish and preparation method 钦州市高新技术产业服务中心 2017-05-10 CN claimed
CN-1233422-C Fragrance mechanism for electronic products WEICHUANG ZITONG CO LTD (CN) 2005-12-28 CN claimed
CN-1391150-A Fragrance mechanism for electronic products WEICHUANG ZITONG CO LTD (CN) 2003-01-15 CN claimed
US-20250185660-A1 METHODS AND COMPOSITIONS FOR DISRUPTING HERBIVOROUS PESTS AND REDUCING CROP DAMAGE USING PREDATORY INSECT SEMIOCHEMICALS THE PENN STATE RESEARCH FOUNDATION 2025-06-12 US disclosed
WO-2024044693-A2 METHODS AND COMPOSITIONS FOR DISRUPTING HERBIVOROUS PESTS AND REDUCING CROP DAMAGE USING PREDATORY INSECT SEMIOCHEMICALS THE PENN STATE RESEARCH FOUNDATION (US) 2024-02-29 WO disclosed
CN-116903644-A Resonant organic compound and application thereof 江苏三月科技股份有限公司 2023-10-20 CN disclosed
CN-113943286-A Preparation method of choline receptor antagonist 上海方予健康医药科技有限公司 2022-01-18 CN disclosed
CN-110114647-A Temperature detection material, temperature detection ink using same, temperature indicator, method for manufacturing temperature detection material, and article management system 株式会社日立产机系统 2019-08-09 CN disclosed
CN-109096417-A A kind of catalyst and olefine polymerizing process for olefinic polymerization 中国石油化工股份有限公司 2018-12-28 CN disclosed
CN-109096424-A A kind of catalyst and olefine polymerizing process for olefinic polymerization 中国石油化工股份有限公司 2018-12-28 CN disclosed
US-4271184-A HYPOTENSIVE, VASODILATORY, ANTICOAGULANT, LUTEOLYTIC, CYTOPROTECTIVE FARMITALIA CARLO ERBA S.P.A. (IT) 1981-06-02 US disclosed
US-4271183-A HYPOTENSIVES, VASODILATORS, ANTICOAGULANTS, ANTISECRETORY, BRONCHODILATORS, ANTIASTHMATICS, LUTEOLYTICS, OXYTOCICS FARMITALIA CARLO ERBA S.P.A. (IT) 1981-06-02 US disclosed
US-4262016-A HYPOTENSIVE, VASODILATORY, ANTI-THROMBOTIC FARMITALIA CARLO ERBA S.P.A. (IT) 1981-04-14 US disclosed
US-4259244-A PROSTAGLANDINS FARMITALIA CARLO ERBA S.P.A. (IT) 1981-03-31 US disclosed
US-4254137-A Bicyclic prostaglandins and process for their preparation FARMITALIA CARLO ERBA S.P.A. (IT) 1981-03-03 US disclosed
US-4250188-A VETERINARY COMPOSITION FARMITALIA CARLO ERBA S.P.A. (IT) 1981-02-10 US disclosed
US-4242508-A PROSTAGLANDINS FARMITALIA CARLO ERBA S.P.A. (IT) 1980-12-30 US disclosed
US-4230721-A 2H-CYCLOPENTA/B/FURAN DERIVATIVES FARMITALIA CARLO ERBA S.P.A. (IT) 1980-10-28 US disclosed