SCHEMBL2830664

SCHEMBL2830664

Cc1ccc(C2C=Cc3ccccc32)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRCP P42785 1/20 0.39
MEN1 O00255 3/20 0.37
KMT2A Q03164 3/20 0.37
GAA P10253 1/20 0.37
MAPT P10636 1/20 0.37
RAB9A P51151 1/20 0.37
HTR2A P28223 2/20 0.35
HTR6 P50406 1/20 0.35
HDAC4 P56524 1/20 0.35
CYP3A4 P08684 2/20 0.35
CYP1A2 P05177 1/20 0.35
CYP2C9 P11712 1/20 0.35
CYP2C19 P33261 1/20 0.35
LMNA P02545 2/20 0.33
ACHE P22303 2/20 0.33
TSHR P16473 1/20 0.33
ALOX12 P18054 1/20 0.33
SIGMAR1 Q99720 2/20 0.33
SLC6A2 P23975 2/20 0.33
SLC6A3 Q01959 2/20 0.33

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
SCHEMBL1028466 0.85 HTR2A (0.39) HTR2AHTR6CYP3A4LMNASIGMAR1
SCHEMBL5084751 0.85 HTR6 (0.33) PRCPHTR2AHTR6
SCHEMBL6285049 0.85 TACR1 (0.38) PRCPMEN1KMT2AHTR2AHTR6
Lithium SCHEMBL9145147 0.83 HTR2A (0.38) HTR2AHTR6CYP3A4LMNASIGMAR1
SCHEMBL9145850 0.83 HTR2A (0.38) HTR2AHTR6CYP3A4LMNASIGMAR1
Methane SCHEMBL28813011 0.83 HTR2A (0.38) HTR2AHTR6CYP3A4LMNASIGMAR1
SCHEMBL9145143 0.83 HTR2A (0.38) HTR2AHTR6CYP3A4LMNASIGMAR1
SCHEMBL9145856 0.83 HTR2A (0.38) HTR2AHTR6CYP3A4LMNASIGMAR1
Ammonia Solution, Strong SCHEMBL21245914 0.83 HTR2A (0.38) HTR2AHTR6CYP3A4LMNASIGMAR1
SCHEMBL15814999 0.82 KDM1A (0.37) MEN1KMT2ARAB9AHTR2AHTR6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2826804-A1 POLYMER CONTAINING THIOPHENE-BENZENE-THIOPHENE UNIT, PREPARATION METHOD THEREFOR AND SOLAR CELL DEVICE Ocean's King Lighting Science&Technology Co., Ltd. (CN) 2015-01-21 EP disclosed
EP-2826803-A1 POLYMER CONTAINING THIOPHENE-BENZENE-THIOPHENE UNIT, PREPARATION METHOD THEREFOR AND SOLAR CELL DEVICE Ocean's King Lighting Science&Technology Co., Ltd. (CN) 2015-01-21 EP disclosed
EP-1847553-B1 METHOD FOR REMOVING METAL AND METHOD FOR PRODUCING POLYMER NIPPON SODA CO (JP) 2014-10-08 EP disclosed
EP-1847556-B1 POLYMER, CROSSLINKED POLYMER, COMPOSITION FOR SOLID POLYMER ELECTROLYTE, SOLID POLYMER ELECTROLYTE AND ADHESIVE COMPOSITION NIPPON SODA CO (JP) 2010-12-08 EP disclosed
US-7649079-B2 Method for removing metal and method for producing polymer NIPPON SODA CO., LTD. (JP) 2010-01-19 US disclosed
US-7645830-B2 Polymer, crosslinked polymer, composition for solid polymer electrolyte, solid polymer electrolyte, and adhesive composition NIPPON SODA CO., LTD. (JP) 2010-01-12 US disclosed
US-20080166636-A1 Polymer, Crosslinked Polymer, Composition for Solid Polymer Electrolyte, Solid Polymer Electrolyte, and Adhesive Composition NIPPON SODA CO., LTD. (JP) 2008-07-10 US disclosed
US-20080119635-A1 Removing metallic ruthenium incorporated within a ruthenium complex from a polymerization system by adding a compound, in particular a nitrile, that is capable of coordinating with ruthenium via substitution of a ligand of ruthenium complex, thereby precipitating another easily removed ruthenium complex NIPPON SODA CO., LTD. (JP) 2008-05-22 US disclosed
EP-1847556-A1 POLYMER, CROSSLINKED POLYMER, COMPOSITION FOR SOLID POLYMER ELECTROLYTE, SOLID POLYMER ELECTROLYTE AND ADHESIVE COMPOSITION NIPPON SODA CO., LTD. (JP) 2007-10-24 EP disclosed
EP-1847553-A1 METHOD FOR REMOVING METAL AND METHOD FOR PRODUCING POLYMER NIPPON SODA CO., LTD. (JP) 2007-10-24 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-20080119635-A1 Removing metallic ruthenium incorporated within a ruthenium complex from a polymerization system by adding a compound, in particular a nitrile, that is capable of coordinating with ruthenium via substitution of a ligand of ruthenium complex, thereby precipitating another easily removed ruthenium complex SRP54, RNF4, RPL7 PRCP 589/4885MEN1 2983/4885KMT2A 3717/4885

“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.