SCHEMBL2830663

SCHEMBL2830663

Cc1ccccc1C1C=Cc2ccccc21

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 4/20 0.37
SIGMAR1 Q99720 6/20 0.36
HTR2A P28223 3/20 0.36
TSHR P16473 1/20 0.36
ACHE P22303 1/20 0.36
HTR6 P50406 1/20 0.36
HTR2B P41595 2/20 0.34
BRD4 O60885 1/20 0.33
CCL2 P13500 1/20 0.33
HDAC4 P56524 1/20 0.33
KDM4E B2RXH2 1/20 0.33
LMNA P02545 1/20 0.33
TP53 P04637 1/20 0.33
CHRM2 P08172 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2D6 P10635 1/20 0.33
CHRM1 P11229 1/20 0.33
DRD2 P14416 1/20 0.33
ADRA2B P18089 1/20 0.33
ADRA2C P18825 1/20 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
SCHEMBL6055955 0.86 HTR2C (0.40) HTR2CSIGMAR1HTR2ATSHRACHE
SCHEMBL28806765 0.82 ALDH1A1 (0.34) HTR2CTSHRCYP3A4HSD17B10
SCHEMBL17835299 0.79 ALDH1A1 (0.36) SIGMAR1TSHRHDAC4LMNATP53
SCHEMBL30355050 0.79 ALDH1A1 (0.36) SIGMAR1TSHRHDAC4LMNATP53
SCHEMBL19630560 0.78 HTR2A (0.39) HTR2CSIGMAR1HTR2AHTR6HTR2B
SCHEMBL29386036 0.78 HTR2A (0.39) HTR2CSIGMAR1HTR2AHTR6HTR2B
SCHEMBL7760865 0.78 SIGMAR1 (0.32) HTR2CSIGMAR1HTR2AHTR6
SCHEMBL2964355 0.78 ALDH1A1 (0.32) SIGMAR1HTR2AHTR6
SCHEMBL7169225 0.78 MEN1 (0.44) HTR2AACHEDRD2NFKB1
SCHEMBL2830664 0.78 PRCP (0.39) HTR2CSIGMAR1HTR2ATSHRACHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
CN-100575324-C Transition metal compounds, ligand systems, catalyst systems and their use in the polymerization and copolymerization of olefins BASELL POLYPROPYLEN GMBH 2009-12-30 CN 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
CN-1249096-C Transition metal compounds, ligand systems, catalyst systems and their use in the polymerization and copolymerization of olefins BASELL POLYPROPYLEN GMBH (DE) 2006-04-05 CN disclosed
US-6284905-B1 GROUP 4 TRANSITION METAL COMPLEX CONTAINING A BORON OR ALUMINUM BRIDGING GROUP CONTAINING A NITROGEN CONTAINING ELECTRON DONATING GROUP, ESPECIALLY AN AMIDO GROUP; OLEFIN SOLUTION OR SLURRY POLYMERIZATION CATALYSTS THE DOW CHEMICAL COMPANY 2001-09-04 US disclosed
WO-2001058912-A1 DINUCLEAR GROUP 4 METAL BORON OR ALUMINUM BRIDGE CONTAINING ANSA-COMPLEXES THE DOW CHEMICAL COMPANY (US) 2001-08-16 WO disclosed
EP-1119575-A1 BRIDGED METAL COMPLEXES THE DOW CHEMICAL COMPANY (US) 2001-08-01 EP disclosed
US-6197990-B1 REACTING CYCLOPENTADIENE AND METAL HYDRIDE IN PRESENCE OF AMINE COMPOUND SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2001-03-06 US disclosed
EP-1027314-A1 COUPLING REACTIONS OF 2-SUBSTITUTED, 7-HALOINDENES WITH ARYL SUBSTITUENTS TO PRODUCE METALLOCENE CATALYST LIGANDS BOULDER SCIENTIFIC COMPANY (US) 2000-08-16 EP disclosed
WO-2000020462-A2 BRIDGED METAL COMPLEXES FOR GAS PHASE POLYMERIZATIONS BP CHEMICALS LIMITED (GB) 2000-04-13 WO disclosed
WO-2000020426-A1 BRIDGED METAL COMPLEXES THE DOW CHEMICAL COMPANY (US) 2000-04-13 WO disclosed
WO-2000007968-A1 COUPLING REACTIONS OF 2-SUBSTITUTED, 7-HALOINDENES WITH ARYL SUBSTITUENTS TO PRODUCE METALLOCENE CATALYST LIGANDS BOULDER SCIENTIFIC COMPANY (US) 2000-02-17 WO disclosed
EP-0963990-A1 PROCESS FOR PRODUCING CYCLOPENTADIENYL METAL SALTS AND PROCESS FOR PRODUCING CYCLOPENTADIENE DERIVATIVES BY UTILIZING THE SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1999-12-15 EP disclosed
US-3934069-A Non-smudging pressure-sensitive copying material BASF AKTIENGESELLSCHAFT (DT) 1976-01-20 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 (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 HTR2C 4239/4885SIGMAR1 2066/4885HTR2A 4740/4885

“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.