Benzene

Benzene

SCHEMBL8518614

CCCCCCc1ccccc1.c1ccccc1

nearest known ligand 0.81

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KCNH2 Q12809 1/20 0.71
▸ SIGMAR1 Q99720 6/20 0.62
▸ ESR1 P03372 2/20 0.61
▸ ADRA2A P08913 2/20 0.61
▸ ADORA3 P0DMS8 2/20 0.61
▸ TACR2 P21452 2/20 0.61
▸ SLC6A2 P23975 2/20 0.61
▸ SLC6A4 P31645 2/20 0.61
▸ SLC6A3 Q01959 2/20 0.61
▸ HTR2A P28223 2/20 0.61
▸ KDM4E B2RXH2 1/20 0.61
▸ ALDH1A1 P00352 1/20 0.61
▸ LMNA P02545 1/20 0.61
▸ SHBG P04278 1/20 0.61
▸ TP53 P04637 1/20 0.61
▸ CYP3A4 P08684 1/20 0.61
▸ HSPD1 P10809 1/20 0.61
▸ ADRB3 P13945 1/20 0.61
▸ HTR2C P28335 1/20 0.61
▸ HSPE1 P61604 1/20 0.61

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 SCHEMBL8518570 1.00 KCNH2 (0.71) KCNH2SIGMAR1ESR1ADRA2AADORA3
SCHEMBL33437 1.00 KCNH2 (0.71) KCNH2SIGMAR1ESR1ADRA2AADORA3
SCHEMBL8679386 1.00 KCNH2 (0.71) KCNH2SIGMAR1ESR1ADRA2AADORA3
Benzene SCHEMBL2355019 1.00 KCNH2 (0.71) KCNH2SIGMAR1ESR1ADRA2AADORA3
SCHEMBL4932286 1.00 KCNH2 (0.71) KCNH2SIGMAR1ESR1ADRA2AADORA3
SCHEMBL8678550 1.00 KCNH2 (0.71) KCNH2SIGMAR1ESR1ADRA2AADORA3
SCHEMBL1619768 1.00 KCNH2 (0.71) KCNH2SIGMAR1ESR1ADRA2AADORA3
SCHEMBL29401 1.00 KCNH2 (0.71) KCNH2SIGMAR1ESR1ADRA2AADORA3
SCHEMBL1331102 1.00 KCNH2 (0.71) KCNH2SIGMAR1ESR1ADRA2AADORA3
SCHEMBL8614349 1.00 KCNH2 (0.71) KCNH2SIGMAR1ESR1ADRA2AADORA3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101925561-A The method for preparing phenylcyclohexane EXXONMOBIL CHEM PATENTS INC 2010-12-22 — — CN disclosed
EP-0611119-B1 Optically active compound, liquid crystal composition containing same, liquid crystal device, display apparatus and display method CANON KK (JP) 1999-06-23 — — EP disclosed
US-5830386-A FLUOROALKYL-SUBSTITUTED PYRIMIDINE CANON KABUSHIKI KAISHA (JP) 1998-11-03 — — US disclosed
EP-0467260-B1 Mesomorphic compound and liquid crystal composition containing same for use in liquid crystal device and display apparatus CANON KK (JP) 1996-10-16 — — EP disclosed
EP-0476567-B1 Mesomorphic compound, liquid crystal composition, liquid crystal device, display apparatus and display method CANON KK (JP) 1996-06-12 — — EP disclosed
EP-0611119-A2 Optically active compound, liquid crystal composition containing same, liquid crystal device, display apparatus and display method CANON KABUSHIKI KAISHA (JP) 1994-08-17 — — EP disclosed
US-5244595-A Phenylthiophene compounds CANON KABUSHIKI KAISHA (JP) 1993-09-14 — — US disclosed
US-5217645-A Low temperature, high speed response CANON KABUSHIKI KAISHA (JP) 1993-06-08 — — US disclosed
EP-0476567-A1 Mesomorphic compound, liquid crystal composition, liquid crystal device, display apparatus and display method CANON KABUSHIKI KAISHA (JP) 1992-03-25 — — EP disclosed
EP-0467260-A2 Mesomorphic compound and liquid crystal composition containing same for use in liquid crystal device and display apparatus CANON KABUSHIKI KAISHA (JP) 1992-01-22 — — EP disclosed
EP-0301511-B1 OPTICALLY ACTIVE COMPOUND AND LIQUID CRYSTAL COMPOSITION CONTAINING SAME CANON KABUSHIKI KAISHA (JP) 1992-01-22 — — EP disclosed
US-5073306-A Trifluoromethylalkyl substituted CANON KABUSHIKI KAISHA (JP) 1991-12-17 — — US disclosed
US-4918213-A HAVING A TRIFLUOROMETHYL GROUP ATTACHED TO ASYMMETRIC CARBON ATOM; STABLE; OPTICAL DEVICES CANON KABUSHIKI KAISHA (JP) 1990-04-17 — — US disclosed
EP-0301511-A1 Optically active compound and liquid crystal composition containing same CANON KABUSHIKI KAISHA (JP) 1989-02-01 — — EP disclosed
US-4230719-A Novel 2-[4-(3-methyl-2-thienyl)phenyl]propionic acid and pharmaceutically acceptable salt thereof and method for treating symptoms of inflammation and pain TOYAMA CHEMICAL CO., LTD. (JP) 1980-10-28 — — US disclosed
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