SCHEMBL1109740

SCHEMBL1109740

C1=C(c2ccccc2)CCCCC1

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ACMSD Q8TDX5 2/20 0.47
ELANE P08246 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
PTGS2 P35354 1/20 0.45
SIGMAR1 Q99720 1/20 0.43
HTR2C P28335 1/20 0.42
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
FFAR2 O15552 1/20 0.41
MAT2A P31153 1/20 0.40
SERPINE1 P05121 1/20 0.39
CHRNB4 P30926 1/20 0.39
CHRNA3 P32297 1/20 0.39
HTR1A P08908 1/20 0.39

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
SCHEMBL1094677 1.00 ACMSD (0.47) ACMSDELANETDP1PTGS2SIGMAR1
SCHEMBL1094678 1.00 ACMSD (0.47) ACMSDELANETDP1PTGS2SIGMAR1
SCHEMBL8356129 1.00 ACMSD (0.47) ACMSDELANETDP1PTGS2SIGMAR1
SCHEMBL8359816 1.00 ACMSD (0.47) ACMSDELANETDP1PTGS2SIGMAR1
SCHEMBL1094676 1.00 ACMSD (0.47) ACMSDELANETDP1PTGS2SIGMAR1
SCHEMBL1109745 1.00 ACMSD (0.47) ACMSDELANETDP1PTGS2SIGMAR1
SCHEMBL8360447 1.00 ACMSD (0.47) ACMSDELANETDP1PTGS2SIGMAR1
SCHEMBL1109744 1.00 ACMSD (0.47) ACMSDELANETDP1PTGS2SIGMAR1
SCHEMBL191429 0.98 ACMSD (0.49) ACMSDELANETDP1PTGS2SIGMAR1
SCHEMBL8380044 0.98 ACMSD (0.49) ACMSDELANETDP1PTGS2SIGMAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4293717-A Process for preparing aldehydes and diols BAYER AKTIENGESELLSCHAFT (DE) 1981-10-06 US claimed
CN-119264026-A Method for synthesizing cyclic sulfonamide and sulfonyl olefin by mechanical light excitation 西北大学 2025-01-07 CN disclosed
US-9493704-B2 Cycloheptane derivative and preparation method and use thereof SHIJIAZHUANG CHENGZHI YONGHUA DISPLAY MATERIALS CO., LTD. (CN) 2016-11-15 US disclosed
US-20150252261-A1 CYCLOHEPTANE DERIVATIVE AND PREPARATION METHOD AND USE THEREOF SHIJIAZHUANG CHENGZHI YONGHUA DISPLAY MATERIALS CO., LTD (CN) 2015-09-10 US disclosed
US-8822548-B2 Compounds with activity at estrogen receptors ACADIA PHARMACEUTICALS INC. (US) 2014-09-02 US disclosed
EP-2279995-B1 Process for the production of cycloalkyl alkyl ethers ZEON CORP (JP) 2013-09-18 EP disclosed
US-8017813-B2 Process for production of cycloalkyl alkyl ethers ZEON CORPORATION (JP) 2011-09-13 US disclosed
US-20110046237-A1 COMPOUNDS WITH ACTIVITY AT ESTROGEN RECEPTORS ACADIA PHARMACEUTICALS INC. (US) 2011-02-24 US disclosed
EP-2279995-A2 Process for producing cycloalkyl alkyl ethers Zeon Corporation (JP) 2011-02-02 EP disclosed
US-7825265-B2 di-aromatic compounds for treatment and prevention of diseases and disorders related to estrogen receptors; 2-fluoro-1-methoxy-4-(1-phenyl-cyclohexyl)-benzene ACADIA PHARMACEUTICALS INC. (US) 2010-11-02 US disclosed
WO-2001070675-A2 INHIBITORS OF HISTONE DEACETYLASE METHYLGENE, INC. (CA) 2001-09-27 WO disclosed
US-5932642-A Cyclic phosphinic acid derivatives as stabilizers CIBA SPECIALTY CHEMICALS CORPORATION (US) 1999-08-03 US disclosed
US-4293717-A Process for preparing aldehydes and diols BAYER AKTIENGESELLSCHAFT (DE) 1981-10-06 US disclosed
US-4052416-A FIRE RETARDANTS, FUEL ADDITIVES, AGRICULTURE, PLASTICIZING, CHEMICAL INTERMEDIATES ALELIO GAETANO F D 1977-10-04 US disclosed
US-4016224-A FIRE RETARDANTS, FUEL ADDITIVES, PLASTICIZERS ALELIO GAETANO F D 1977-04-05 US disclosed
US-3985835-A A PHOSPHORUS-HALOGEN-NITROGEN CONTAINING COMPOUND ALELIO GAETANO F D 1976-10-12 US disclosed
US-3980737-A FIRE RETARDANTS, AGRICULTURAL CHEMICALS, FUEL ADDITIVES, PLASTICIZERS, INTERMEDIATES ALELIO GAETANO F D 1976-09-14 US disclosed
US-3972944-A BORON OXIDE, BORIC ACID OR BORATE AND VANADIUM OR MOLYBDENUM CONTAINING CATALYST BAYER AKTIENGESELLSCHAFT (DT) 1976-08-03 US disclosed
US-3970727-A Halogenated esters of phosphorus-containing acids ALELIO GAETANO F D 1976-07-20 US disclosed
US-3950457-A ADDITION POLYMERS OF UNSATURATED CARBOXYLATES ALELIO GAETANO F D 1976-04-13 US 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 (2 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-20110046237-A1 COMPOUNDS WITH ACTIVITY AT ESTROGEN RECEPTORS ESR2, ESR1, GPER1 ACMSD 4071/4885ELANE 826/4885TDP1 2292/4885
US-20150252261-A1 CYCLOHEPTANE DERIVATIVE AND PREPARATION METHOD AND USE THEREOF DHPS, DHCR24, CCNT1 ACMSD 645/4885ELANE 3954/4885TDP1 1611/4885

“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.