SCHEMBL6841872

SCHEMBL6841872

CC(C)(C)C=CCc1ccccc1

nearest known ligand 0.61

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAOB P27338 1/20 0.61
CA1 P00915 1/20 0.47
CA2 P00918 1/20 0.47
ARG2 P78540 1/20 0.47
SLC6A2 P23975 1/20 0.41
TAAR1 Q96RJ0 1/20 0.41
CYP2D6 P10635 2/20 0.39
CYP3A4 P08684 2/20 0.39
CYP1A2 P05177 1/20 0.39
PRMT1 Q99873 1/20 0.39
TOP1 P11387 1/20 0.39
LMNA P02545 1/20 0.39
TP53 P04637 1/20 0.39
KCNH2 Q12809 2/20 0.38
ALDH1A1 P00352 1/20 0.37
CYP2C9 P11712 1/20 0.37
CYP2C19 P33261 1/20 0.37
CALM1 P0DP23 1/20 0.36
MAPK1 P28482 1/20 0.36

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
SCHEMBL28437962 0.78 GPR52 (0.46) MAOBALDH1A1
SCHEMBL6067623 0.78 MAOB (0.50) MAOBCA1CA2ARG2SLC6A2
SCHEMBL29718928 0.77 MAOB (0.61) MAOBCA1CA2ARG2TOP1
SCHEMBL155054 0.77 MAOB (1.00) MAOBCA1CA2ARG2TAAR1
SCHEMBL155055 0.77 MAOB (1.00) MAOBCA1CA2ARG2TAAR1
SCHEMBL1524697 0.77 MAOB (1.00) MAOBCA1CA2ARG2TAAR1
SCHEMBL315315 0.76 MAOB (0.52) MAOBCA1CA2ARG2SLC6A2
SCHEMBL28425206 0.76 MAOB (0.58) MAOBCA1CA2ARG2CYP1A2
Tert-Butanol SCHEMBL8960018 0.76 MAOB (0.58) MAOBCA1CA2ARG2SLC6A2
SCHEMBL9955927 0.74 TP53 (0.47) MAOBCA1CA2ARG2SLC6A2

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 8 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
EP-1153977-A1 RESIN COMPOSITION, BINDER RESIN FOR TONER AND TONER IDEMITSU KOSAN COMPANY LIMITED (JP) 2001-11-14 EP disclosed