SCHEMBL3025006

SCHEMBL3025006

CCc1ccc(CCCc2ccccc2)cc1

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.70
HTR2A P28223 1/20 0.60
MAOB P27338 2/20 0.54
CHRM2 P08172 1/20 0.54
HTR1A P08908 1/20 0.54
ADRA2A P08913 1/20 0.54
CHRM1 P11229 1/20 0.54
DRD1 P21728 1/20 0.54
SLC6A2 P23975 1/20 0.54
SLC6A4 P31645 1/20 0.54
ADRA1A P35348 1/20 0.54
OPRM1 P35372 1/20 0.54
DRD3 P35462 1/20 0.54
SLC6A3 Q01959 1/20 0.54
KCNH2 Q12809 1/20 0.54
TAAR1 Q96RJ0 1/20 0.52
SIGMAR1 Q99720 3/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
MAOA P21397 1/20 0.50
MEN1 O00255 1/20 0.50

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
SCHEMBL6548137 0.95 TP53 (0.70) TP53HTR2AMAOBCHRM2HTR1A
SCHEMBL633290 0.90 TP53 (0.78) TP53HTR2AMAOBCHRM2HTR1A
Butylbenzyl SCHEMBL7170859 0.88 TP53 (0.67) TP53CHRM2HTR1AADRA2ACHRM1
SCHEMBL14117401 0.88 TSHR (0.58) TP53HTR2AMAOBCHRM2HTR1A
Ethylbenzene SCHEMBL8093416 0.87 TP53 (0.82) TP53HTR2AMAOBCHRM2HTR1A
Ethylbenzene SCHEMBL27405402 0.87 TP53 (0.93) TP53TAAR1MEN1KMT2A
SCHEMBL9069707 0.87 HTR2A (0.75) HTR2AMAOBADRA1ASLC6A3SIGMAR1
SCHEMBL6546196 0.85 HTR2A (0.60) HTR2AMAOBCHRM2HTR1AADRA2A
SCHEMBL10575050 0.84 TAAR1 (0.62) TP53HTR2AMAOBCHRM2ADRA2A
SCHEMBL15347959 0.84 HTR2A (0.71) HTR2AMAOBADRA1ASLC6A3SIGMAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2158233-B1 ADDUCTS, ADDUCTS AND OLIGOMERS, OR ADDUCTS, OLIGOMERS AND LOW MOLECULAR WEIGHT POLYMERS, AND THEIR PREPARATION ALBEMARLE CORP (US) 2018-10-31 EP claimed
US-20130210995-A1 ADDUCTS, ADDUCTS AND OLIGOMERS, OR ADDUCTS, OLIGOMERS AND LOW MOLECULAR WEIGHT POLYMERS, AND THEIR PREPARATION ALBEMARLE CORPORATION (US) 2013-08-15 US claimed
US-20100184941-A1 ADDUCTS, ADDUCTS AND OLIGOMERS, OR ADDUCTS, OLIGOMERS AND LOW MOLECULAR WEIGHT POLYMERS, AND THEIR PREPARATION ALBEMARLE CORPORATION (US) 2010-07-22 US claimed
EP-2158233-A2 ADDUCTS, ADDUCTS AND OLIGOMERS, OR ADDUCTS, OLIGOMERS AND LOW MOLECULAR WEIGHT POLYMERS, AND THEIR PREPARATION Albermarle Corporation (US) 2010-03-03 EP claimed
WO-2008154454-A2 ADDUCTS, ADDUCTS AND OLIGOMERS, OR ADDUCTS, OLIGOMERS AND LOW MOLECULAR WEIGHT POLYMERS, AND THEIR PREPARATION ALBEMARLE CORPORATION (US) 2008-12-18 WO claimed
EP-2158233-B1 ADDUCTS, ADDUCTS AND OLIGOMERS, OR ADDUCTS, OLIGOMERS AND LOW MOLECULAR WEIGHT POLYMERS, AND THEIR PREPARATION ALBEMARLE CORP (US) 2018-10-31 EP disclosed
US-8822743-B2 Adducts, adducts and oligomers, or adducts, oligomers and low molecular weight polymers, and their preparation ALBEMARLE CORPORATION (US) 2014-09-02 US disclosed
US-20130210995-A1 ADDUCTS, ADDUCTS AND OLIGOMERS, OR ADDUCTS, OLIGOMERS AND LOW MOLECULAR WEIGHT POLYMERS, AND THEIR PREPARATION ALBEMARLE CORPORATION (US) 2013-08-15 US disclosed
US-8420876-B2 Adducts, adducts and oligomers, or adducts, oligomers and low molecular weight polymers, and their preparation ALBEMARLE CORPORATION (US) 2013-04-16 US disclosed
US-20100184941-A1 ADDUCTS, ADDUCTS AND OLIGOMERS, OR ADDUCTS, OLIGOMERS AND LOW MOLECULAR WEIGHT POLYMERS, AND THEIR PREPARATION ALBEMARLE CORPORATION (US) 2010-07-22 US disclosed
EP-2158233-A2 ADDUCTS, ADDUCTS AND OLIGOMERS, OR ADDUCTS, OLIGOMERS AND LOW MOLECULAR WEIGHT POLYMERS, AND THEIR PREPARATION Albermarle Corporation (US) 2010-03-03 EP disclosed
WO-2008154454-A2 ADDUCTS, ADDUCTS AND OLIGOMERS, OR ADDUCTS, OLIGOMERS AND LOW MOLECULAR WEIGHT POLYMERS, AND THEIR PREPARATION ALBEMARLE CORPORATION (US) 2008-12-18 WO disclosed
EP-0717098-B1 A refrigerating machine oil and a fluid composition for use in a refrigerating machine NIPPON MITSUBISHI OIL CORP (JP) 2004-01-21 EP disclosed
US-5817251-A AROMATIC HYDROCARBON LUBRICANT NIPPON OIL CO., LTD. (JP) 1998-10-06 US disclosed
US-5711895-A Fluid composition for use in a refrigerating machine in which the refrigerating machine oil is at least one hydrocarbon compound of a formula consisting of two phenyl groups joined through an alkylene or alkenylene group NIPPON OIL CO., LTD. (JP) 1998-01-27 US disclosed
EP-0717098-A2 A refrigerating machine oil and a fluid composition for use in a refrigerating machine NIPPON OIL CO. LTD. (JP) 1996-06-19 EP 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 (1 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-20100184941-A1 ADDUCTS, ADDUCTS AND OLIGOMERS, OR ADDUCTS, OLIGOMERS AND LOW MOLECULAR WEIGHT POLYMERS, AND THEIR PREPARATION PCNA, OGG1, DDB1 TP53 51/4885HTR2A 2108/4885MAOB 3675/4885

“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.