SCHEMBL6841870

SCHEMBL6841870

C=CCc1ccccc1C(C)(C)C

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 2/20 0.42
GABRB2 P47870 2/20 0.42
ALDH1A1 P00352 3/20 0.40
TSHR P16473 2/20 0.40
TDP1 Q9NUW8 2/20 0.40
CA2 P00918 1/20 0.37
ELANE P08246 1/20 0.35
ADRB2 P07550 3/20 0.35
ADRB1 P08588 3/20 0.35
LMNA P02545 2/20 0.35
HTR1A P08908 1/20 0.35
ADRB3 P13945 1/20 0.35
ADRA2C P18825 1/20 0.35
SLC6A2 P23975 1/20 0.35
BDKRB2 P30411 1/20 0.35
SLC6A4 P31645 1/20 0.35
ADRA1A P35348 1/20 0.35
HTR2B P41595 1/20 0.35
KCNH2 Q12809 1/20 0.35
CYP1A2 P05177 1/20 0.35

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
SCHEMBL2003722 0.86 GABRA1 (0.41) GABRA1GABRB2ALDH1A1TSHRTDP1
SCHEMBL278267 0.84 GABRA1 (0.40) GABRA1GABRB2ALDH1A1TSHRTDP1
SCHEMBL4132999 0.84 GABRA1 (0.40) GABRA1GABRB2ALDH1A1TSHRTDP1
Iodide SCHEMBL8165516 0.82 GABRA1 (0.39) GABRA1GABRB2ALDH1A1TSHRTDP1
SCHEMBL9358246 0.82 MAPK1 (0.42) GABRA1GABRB2ALDH1A1TSHRTDP1
Water SCHEMBL2392756 0.82 GABRA1 (0.39) GABRA1GABRB2ALDH1A1TSHRTDP1
Hydrochloric Acid SCHEMBL170004 0.82 GABRA1 (0.39) GABRA1GABRB2ALDH1A1TSHRTDP1
Hydrochloric Acid SCHEMBL28211604 0.82 GABRA1 (0.39) GABRA1GABRB2ALDH1A1TSHRTDP1
Ammonia Solution, Strong SCHEMBL7776228 0.82 GABRA1 (0.39) GABRA1GABRB2ALDH1A1TSHRTDP1
SCHEMBL27775371 0.82 GABRA1 (0.43) GABRA1GABRB2ALDH1A1TSHRTDP1

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
US-20030105240-A1 Resin composition, binder resin for toner and toner IDEMITSU KOSAN CO., LTD. (JP) 2003-06-05 US claimed
EP-1153977-A1 RESIN COMPOSITION, BINDER RESIN FOR TONER AND TONER IDEMITSU KOSAN COMPANY LIMITED (JP) 2001-11-14 EP claimed
US-6756170-B2 BINDER RESIN AND A RELEASANT, WHEREIN THE BINDER RESIN COMPRISES A PETROLEUM RESIN AND A STYRENE-BASED COPOLYMER OR STYRENE-BASED HOMOPOLYMER IN AN AMOUNT OF 5:5 TO 7:3 BY WEIGHT IN TERMS OF THE RATIO OF THE PETROLEUM RESIN:STYRENE-BASED TOYO INK MANUFACTURING CO., LTD. (JP) 2004-06-29 US disclosed
US-20030124446-A1 Electrostatic image developing toner and image-forming method using the same TOYO INK MANUFACTURING CO., LTD. 2003-07-03 US disclosed
EP-1324144-A2 Electrostatic image developing toner and image-forming method using the same Toyo Ink Manufacturing Co. Ltd. (JP) 2003-07-02 EP disclosed
US-20030105240-A1 Resin composition, binder resin for toner and toner IDEMITSU KOSAN CO., LTD. (JP) 2003-06-05 US disclosed
US-6538063-B1 Polystyrene and petroleum resins; electrography, electrostatic images IDEMITSU KOSAN CO., LTD. (JP) 2003-03-25 US disclosed
US-6534595-B2 Blend of thermosetting resin, decomposable resin and solvent SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2003-03-18 US disclosed
EP-1153977-A1 RESIN COMPOSITION, BINDER RESIN FOR TONER AND TONER IDEMITSU KOSAN COMPANY LIMITED (JP) 2001-11-14 EP disclosed
US-20010038887-A1 Coating solution for forming porous organic film SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2001-11-08 US disclosed